Vitas-M small molecule compound

N-benzyl-2-{[(4-methylphenyl)sulfonyl]amino}-1-phenyl-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

Catalog ID
STK543194
SMILES Cc1ccc(cc1)S(=O)(=O)Nc1c(C(=O)NCc2ccccc2)c2c(n1c1ccccc1)nc1c(n2)cccc1

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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 C31H25N5O3S MW 547.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25N5O3S/c1-21-16-18-24(19-17-21)40(38,39)35-29-27(31(37)32-20-22-10-4-2-5-11-22)28-30(36(29)23-12-6-3-7-13-23)34-26-15-9-8-14-25(26)33-28/h2-19,35H,20H2,1H3,(H,32,37)
InChIKey
VAIDAASGBDHZJL-UHFFFAOYSA-N
Synonyms
499116-11-9
499116119
CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC=CC=C5)C(=O)NCC6=CC=CC=C6
InChI=1SC31H25N5O3Sc121161824(191721)40(3839)352927(31(37)322022104251122)2830(36(29)23126371323)342615981425(26)3328h21935H20H21H3(H3237)
MFCD03302365
Nbenzyl2(((4methylphenyl)sulfonyl)amino)1phenyl1Hpyrrolo(23b)quinoxaline3carboxamide
NBENZYL2((4METHYLPHENYL)SULFONYLAMINO)1PHENYLPYRROLO(32B)QUINOXALINE3CARBOXAMIDE
Nbenzyl2(4methylphenylsulfonamido)1phenyl1Hpyrrolo(23b)quinoxaline3carboxamide
ZINC000002351500
ZINC2351500

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.