Vitas-M small molecule compound

3-bromo-N-{1-cyclohexyl-3-[(4-methylphenyl)sulfonyl]-1H-pyrrolo[2,3-b]quinoxalin-2-yl}benzamide

Catalog ID
STK533230
SMILES Cc1ccc(cc1)S(=O)(=O)c1c(NC(=O)c2cccc(c2)Br)n(c2c1nc1ccccc1n2)C1CCCCC1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C30H27BrN4O3S MW 603.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27BrN4O3S/c1-19-14-16-23(17-15-19)39(37,38)27-26-28(33-25-13-6-5-12-24(25)32-26)35(22-10-3-2-4-11-22)29(27)34-30(36)20-8-7-9-21(31)18-20/h5-9,12-18,22H,2-4,10-11H2,1H3,(H,34,36)
InChIKey
ONLZRCOWAYWPCQ-UHFFFAOYSA-N
Synonyms

3bromoN(1cyclohexyl3((4methylphenyl)sulfonyl)1Hpyrrolo(23b)quinoxalin2yl)benzamide
3BROMON(1CYCLOHEXYL3(4METHYLPHENYL)SULFONYLPYRROLO(32B)QUINOXALIN2YL)BENZAMIDE
3bromoN(1cyclohexyl3tosyl1Hpyrrolo(23b)quinoxalin2yl)benzamide
CC1=CC=C(C=C1)S(=O)(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)C5CCCCC5)NC(=O)C6=CC(=CC=C6)Br
InChI=1SC30H27BrN4O3Sc119141623(171519)39(3738)272628(332513651224(25)3226)35(22103241122)29(27)3430(36)2087921(31)1820h59121822H241011H21H3(H3436)
MFCD01953588
ZINC000102412360
ZINC102412360

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Available files

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