NCI-35847 FREE BASE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C26H23N7O4
Molecular Weight	497.5053
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[O-][N+](=O)C1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)C3=NCCN3)C(=O)NC4=CC=C(C=C4)C5=NCCN5

InChI

InChIKey=WQZYYJRVBIQUGH-UHFFFAOYSA-N

InChI=1S/C26H23N7O4/c34-25(31-19-6-1-16(2-7-19)23-27-11-12-28-23)18-5-10-21(22(15-18)33(36)37)26(35)32-20-8-3-17(4-9-20)24-29-13-14-30-24/h1-10,15H,11-14H2,(H,27,28)(H,29,30)(H,31,34)(H,32,35)

HIDE SMILES / InChI

Molecular Formula	C26H23N7O4
Molecular Weight	497.5053
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 `Tue Apr 01 17:41:21 GMT 2025` Edited by `admin` on `Tue Apr 01 17:41:21 GMT 2025`
Record UNII	8M49S9380J
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NCI-35847 FREE BASE

Common Name

English

NSC-60340

Preferred Name

English

1,4-BENZENEDICARBOXAMIDE, N1,N4-BIS(4-(4,5-DIHYDRO-1H-IMIDAZOL-2-YL)PHENYL)-2-NITRO-

Systematic Name

English

4',4''-DI-2-IMIDAZOLIN-2-YL-2-NITRO-TEREPHTHALANILIDE

Systematic Name

English

N1,N4-BIS(4-(4,5-DIHYDRO-1H-IMIDAZOL-2-YL)PHENYL)-2-NITRO-1,4-BENZENEDICARBOXAMIDE

Systematic Name

English

Code System Code Type Description

CAS

14599-52-1