U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C20H23NS.ClH
Molecular Weight 345.929
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of MEDOSULEPINE HYDROCHLORIDE, (Z)-

SMILES

Cl.CN(C)CC\C=C1\C2=CC=CC=C2CSC3=C1C=C(C)C=C3

InChI

InChIKey=YLXMOQSKRGADRB-NAIZSXBXSA-N
InChI=1S/C20H23NS.ClH/c1-15-10-11-20-19(13-15)18(9-6-12-21(2)3)17-8-5-4-7-16(17)14-22-20;/h4-5,7-11,13H,6,12,14H2,1-3H3;1H/b18-9-;

HIDE SMILES / InChI

Molecular Formula C20H23NS
Molecular Weight 309.468
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:11:21 UTC 2023
Edited
by admin
on Sat Dec 16 11:11:21 UTC 2023
Record UNII
624KTO4SCL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MEDOSULEPINE HYDROCHLORIDE, (Z)-
Common Name English
CIS-METHIADENE HYDROCHLORIDE
Common Name English
1-PROPANAMINE, N,N-DIMETHYL-3-(2-METHYLDIBENZO(B,E)THIEPIN-11(6H)-YLIDENE)-, HYDROCHLORIDE, (Z)-
Systematic Name English
DIBENZO(B,E)THIEPIN-.DELTA.11(6H),.GAMMA.-PROPYLAMINE, N,N,2-TRIMETHYL-, HYDROCHLORIDE, (Z)-
Systematic Name English
Code System Code Type Description
PUBCHEM
6433822
Created by admin on Sat Dec 16 11:11:21 UTC 2023 , Edited by admin on Sat Dec 16 11:11:21 UTC 2023
PRIMARY
FDA UNII
624KTO4SCL
Created by admin on Sat Dec 16 11:11:21 UTC 2023 , Edited by admin on Sat Dec 16 11:11:21 UTC 2023
PRIMARY
CAS
23735-16-2
Created by admin on Sat Dec 16 11:11:21 UTC 2023 , Edited by admin on Sat Dec 16 11:11:21 UTC 2023
PRIMARY