Vitas-M small molecule compound
methyl 2-{[(2-chloro-5-nitrophenyl)carbonyl]amino}-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Catalog ID
STK435422
SMILES COC(=O)c1c(NC(=O)c2cc(ccc2Cl)[N+](=O)[O-])sc(c1C)C(=O)N(C)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 C17H16ClN3O6S MW 425.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClN3O6S/c1-8-12(17(24)27-4)15(28-13(8)16(23)20(2)3)19-14(22)10-7-9(21(25)26)5-6-11(10)18/h5-7H,1-4H3,(H,19,22)InChIKey
KOVYIZFNVIPOKT-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)NC(=O)C2=C(C=CC(=C2)(N+)(=O)(O))Cl)C(=O)N(C)C
COC(=O)c1c(NC(=O)c2cc(ccc2Cl)(N+)(=O)(O))sc(c1C)C(=O)N(C)C
InChI=1SC17H16ClN3O6Sc1812(17(24)274)15(2813(8)16(23)20(2)3)1914(22)1079(21(25)26)5611(10)18h57H14H3(H1922)
methyl2(((2chloro5nitrophenyl)carbonyl)amino)5(dimethylcarbamoyl)4methylthiophene3carboxylate
METHYL2((2CHLORO5NITROBENZOYL)AMINO)5((DIMETHYLAMINO)CARBONYL)4METHYL3THIOPHENECARBOXYLATE
METHYL2((2CHLORO5NITROBENZOYL)AMINO)5(DIMETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
METHYL5(NNDIMETHYLCARBAMOYL)2((2CHLORO5NITROPHENYL)CARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD03394339
ZINC000000657229
ZINC00657229
ZINC657229
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