Vitas-M small molecule compound
ethyl 5-carbamoyl-4-methyl-2-{[(3-methyl-4-nitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Catalog ID
STK460356
SMILES CCOC(=O)c1c(NC(=O)c2ccc(c(c2)C)[N+](=O)[O-])sc(c1C)C(=O)N
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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 C17H17N3O6S MW 391.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O6S/c1-4-26-17(23)12-9(3)13(14(18)21)27-16(12)19-15(22)10-5-6-11(20(24)25)8(2)7-10/h5-7H,4H2,1-3H3,(H2,18,21)(H,19,22)InChIKey
RSLVTAMMKYYFMF-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2=CC(=C(C=C2)(N+)(=O)(O))C
CCOC(=O)c1c(NC(=O)c2ccc(c(c2)C)(N+)(=O)(O))sc(c1C)C(=O)N
ethyl5carbamoyl4methyl2(((3methyl4nitrophenyl)carbonyl)amino)thiophene3carboxylate
ETHYL5CARBAMOYL4METHYL2((3METHYL4NITROBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5CARBAMOYL4METHYL2((3METHYL4NITROPHENYL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC17H17N3O6Sc142617(23)129(3)13(14(18)21)2716(12)1915(22)105611(20(24)25)8(2)710h57H4H213H3(H21821)(H1922)
MFCD03366370
ZINC000006047136
ZINC06047136
ZINC6047136
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