Vitas-M small molecule compound

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

Catalog ID
STK545054
SMILES CCCCOCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)[N+](=O)[O-])S(=O)(=O)c1ccc(cc1)C

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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 C30H31N5O7S2 MW 637.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31N5O7S2/c1-3-4-19-42-20-7-18-34-29-27(31-25-8-5-6-9-26(25)32-29)28(43(38,39)23-14-10-21(2)11-15-23)30(34)33-44(40,41)24-16-12-22(13-17-24)35(36)37/h5-6,8-17,33H,3-4,7,18-20H2,1-2H3
InChIKey
VGJKJEQVOUKWAT-UHFFFAOYSA-N
Synonyms
CCCCOCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=CC=C(C=C4)C)NS(=O)(=O)C5=CC=C(C=C5)(N+)(=O)(O)
CCCCOCCCn1c2nc3ccccc3nc2c(c1NS(=O)(=O)c1ccc(cc1)(N+)(=O)(O))S(=O)(=O)c1ccc(cc1)C
N(1(3butoxypropyl)3((4methylphenyl)sulfonyl)1Hpyrrolo(23b)quinoxalin2yl)4nitrobenzenesulfonamide
N(1(3BUTOXYPROPYL)3(4METHYLPHENYL)SULFONYLPYRROLO(32B)QUINOXALIN2YL)4NITROBENZENESULFONAMIDE
N(1(3butoxypropyl)3tosyl1Hpyrrolo(23b)quinoxalin2yl)4nitrobenzenesulfonamide
Registry IDs
MFCD03667314
ZINC000150426500
ZINC150426500

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Available files

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