Vitas-M small molecule compound

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

Catalog ID
STL327445
SMILES CCCCCn1c2nc3ccccc3nc2c(c1NC(=O)c1ccccc1Cl)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 C29H27ClN4O3S MW 547.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27ClN4O3S/c1-3-4-9-18-34-27-25(31-23-12-7-8-13-24(23)32-27)26(38(36,37)20-16-14-19(2)15-17-20)28(34)33-29(35)21-10-5-6-11-22(21)30/h5-8,10-17H,3-4,9,18H2,1-2H3,(H,33,35)
InChIKey
QFTCBRQVSCHIFD-UHFFFAOYSA-N
Synonyms
373371-25-6
2chloroN(1pentyl3tosyl1Hpyrrolo(23b)quinoxalin2yl)benzamide
2chloroN(3((4methylphenyl)sulfonyl)1pentyl1Hpyrrolo(23b)quinoxalin2yl)benzamide
2CHLORON(3(4METHYLPHENYL)SULFONYL1PENTYLPYRROLO(32B)QUINOXALIN2YL)BENZAMIDE
373371256
CCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=CC=C(C=C4)C)NC(=O)C5=CC=CC=C5Cl
InChI=1SC29H27ClN4O3Sc134918342725(312312781324(23)3227)26(38(3637)20161419(2)151720)28(34)3329(35)2110561122(21)30h581017H34918H212H3(H3335)
MFCD01946018
ZINC000002279661
ZINC2279661

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Available files

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