Vitas-M small molecule compound
1-benzyl-N-[(4-ethoxy-2-nitrophenyl)carbamothioyl]-2,3-dimethyl-1H-indole-5-carboxamide
Catalog ID
STK301365
SMILES CCOc1ccc(c(c1)[N+](=O)[O-])NC(=S)NC(=O)c1ccc2c(c1)c(C)c(n2Cc1ccccc1)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 C27H26N4O4S MW 502.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O4S/c1-4-35-21-11-12-23(25(15-21)31(33)34)28-27(36)29-26(32)20-10-13-24-22(14-20)17(2)18(3)30(24)16-19-8-6-5-7-9-19/h5-15H,4,16H2,1-3H3,(H2,28,29,32,36)InChIKey
OFTQWNCEZRWDEX-UHFFFAOYSA-NSynonyms
438194-55-91benzylN((4ethoxy2nitrophenyl)carbamothioyl)23dimethyl1Hindole5carboxamide
1BENZYLN((4ETHOXY2NITROPHENYL)CARBAMOTHIOYL)23DIMETHYLINDOLE5CARBOXAMIDE
438194559
CCOC1=CC(=C(C=C1)NC(=S)NC(=O)C2=CC3=C(C=C2)N(C(=C3C)C)CC4=CC=CC=C4)(N+)(=O)(O)
CCOc1ccc(c(c1)(N+)(=O)(O))NC(=S)NC(=O)c1ccc2c(c1)c(C)c(n2Cc1ccccc1)C
InChI=1SC27H26N4O4Sc143521111223(25(1521)31(33)34)2827(36)2926(32)2010132422(1420)17(2)18(3)30(24)16198657919h515H416H213H3(H228293236)
MFCD02605154
N((1BENZYL23DIMETHYL1HINDOL5YL)CARBONYL)N(4ETHOXY2NITROPHENYL)THIOUREA
ZINC000008450845
ZINC08450845
ZINC8450845
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