Vitas-M small molecule compound
2-{[(4-methoxy-3-nitrophenyl)carbonyl]amino}-N-phenyl-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
Catalog ID
STK463325
SMILES COc1ccc(cc1[N+](=O)[O-])C(=O)Nc1sc2c(c1C(=O)Nc1ccccc1)CCC2
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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 C22H19N3O5S MW 437.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O5S/c1-30-17-11-10-13(12-16(17)25(28)29)20(26)24-22-19(15-8-5-9-18(15)31-22)21(27)23-14-6-3-2-4-7-14/h2-4,6-7,10-12H,5,8-9H2,1H3,(H,23,27)(H,24,26)InChIKey
KNKUTUQGZWGUHQ-UHFFFAOYSA-NSynonyms
(2((4METHOXY3NITROPHENYL)CARBONYLAMINO)(456TRIHYDROCYCLOPENTA(12B)THIOPHEN3YL))NBENZAMIDE
2(((4methoxy3nitrophenyl)carbonyl)amino)Nphenyl56dihydro4Hcyclopenta(b)thiophene3carboxamide
2((4METHOXY3NITROBENZOYL)AMINO)NPHENYL56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXAMIDE
COC1=C(C=C(C=C1)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)NC4=CC=CC=C4)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C(=O)Nc1sc2c(c1C(=O)Nc1ccccc1)CCC2
InChI=1SC22H19N3O5Sc13017111013(1216(17)25(28)29)20(26)242219(1585918(15)3122)21(27)23146324714h24671012H589H21H3(H2327)(H2426)
MFCD06005220
ZINC000001056251
ZINC01056251
ZINC1056251
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