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Details

Stereochemistry ABSOLUTE
Molecular Formula C38H52N6O2
Molecular Weight 624.8585
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TIRILAZAD

SMILES

[H][C@@]12C[C@@H](C)[C@H](C(=O)CN3CCN(CC3)C4=CC(=NC(=N4)N5CCCC5)N6CCCC6)[C@@]1(C)CC=C7[C@@]2([H])CCC8=CC(=O)C=C[C@]78C

InChI

InChIKey=RBKASMJPSJDQKY-RBFSKHHSSA-N
InChI=1S/C38H52N6O2/c1-26-22-31-29-9-8-27-23-28(45)10-12-37(27,2)30(29)11-13-38(31,3)35(26)32(46)25-41-18-20-43(21-19-41)34-24-33(42-14-4-5-15-42)39-36(40-34)44-16-6-7-17-44/h10-12,23-24,26,29,31,35H,4-9,13-22,25H2,1-3H3/t26-,29-,31+,35-,37+,38+/m1/s1

HIDE SMILES / InChI

Molecular Formula C38H52N6O2
Molecular Weight 624.8585
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:12:33 UTC 2023
Edited
by admin
on Fri Dec 15 17:12:33 UTC 2023
Record UNII
YD064E883I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TIRILAZAD
INN   MI   VANDF   WHO-DD  
INN  
Official Name English
TIRILAZAD [MI]
Common Name English
Tirilazad [WHO-DD]
Common Name English
PREGNA-1,4,9(11)-TRIENE-3,20-DIONE, 21-(4-(2,6-DI-1-PYRROLIDINYL-4-PYRIMIDINYL)-1-PIPERAZINYL)-16-METHYL-, (16.ALPHA.)-
Common Name English
U 74006
Code English
tirilazad [INN]
Common Name English
21-(4-(2,6-DI-1-PYRROLIDINYL-4-PYRIMIDINYL)-1-PIPERAZINYL)-16.ALPHA.-METHYLPREGNA-1,4,9(11)-TRIENE-3,20-DIONE
Common Name English
TIRILAZAD [VANDF]
Common Name English
U-74006
Code English
Classification Tree Code System Code
WHO-VATC QN07XX01
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
WHO-ATC N07XX01
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
NCI_THESAURUS C211
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
Code System Code Type Description
MERCK INDEX
m10889
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
PRIMARY Merck Index
EVMPD
SUB11117MIG
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
PRIMARY
WIKIPEDIA
TIRILAZAD
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
PRIMARY
PUBCHEM
104903
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
PRIMARY
ChEMBL
CHEMBL1908849
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
PRIMARY
DRUG CENTRAL
4063
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
PRIMARY
NCI_THESAURUS
C152658
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
PRIMARY
FDA UNII
YD064E883I
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
PRIMARY
RXCUI
72467
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
PRIMARY RxNorm
EPA CompTox
DTXSID30869521
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
PRIMARY
INN
6616
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
PRIMARY
MESH
C053355
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
PRIMARY
CAS
110101-66-1
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
PRIMARY
DRUG BANK
DB13050
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
PRIMARY
SMS_ID
100000077248
Created by admin on Fri Dec 15 17:12:34 UTC 2023 , Edited by admin on Fri Dec 15 17:12:34 UTC 2023
PRIMARY
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