ZALOSPIRONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H29N5O2
Molecular Weight	419.5194
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12C=C[C@]1([H])[C@@H]3C=C[C@H]2[C@@]4([H])C(=O)N(CCCCN5CCN(CC5)C6=NC=CC=N6)C(=O)[C@@]34[H]

InChI

InChIKey=AERLHOTUXIJQFV-RCPZPFRWSA-N

InChI=1S/C24H29N5O2/c30-22-20-18-6-7-19(17-5-4-16(17)18)21(20)23(31)29(22)11-2-1-10-27-12-14-28(15-13-27)24-25-8-3-9-26-24/h3-9,16-21H,1-2,10-15H2/t16-,17+,18-,19+,20-,21+

HIDE SMILES / InChI

Molecular Formula	C24H29N5O2
Molecular Weight	419.5194
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 `Sat Dec 16 17:03:33 UTC 2023` Edited by `admin` on `Sat Dec 16 17:03:33 UTC 2023`
Record UNII	0449O95Z1J
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ZALOSPIRONE

Official Name

English

WY-47846

Code

English

(1R*,2R*,5S*,6S*,7S*,8R*)-N-(4-(4-(2-PYRIMIDINYL)-1-PIPERAZINYL)BUTYL)TRICYCLO(4.2.2.0(SUP 2,5))DECA-3,9-DIENE-7,8-DICARBOXIMIDE

Common Name

English

4,7-ETHENO-1H-CYCLOBUT(F)ISOINDOLE-1,3(2H)-DIONE, 3A,4,4A,6A,7,7A-HEXAHYDRO-2-(4-(4-(2-PYRIMIDINYL)-1-PIPERAZINYL)BUTYL)-, (3A.ALPHA.,4.BETA.,4A.ALPHA.,6A.ALPHA,7.BETA.,7A.ALPHA.)-

Common Name

English

zalospirone [INN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C265