Vitas-M small molecule compound
ethyl 5-carbamoyl-2-{[(4-methoxy-3-nitrophenyl)carbonyl]amino}-4-methylthiophene-3-carboxylate
Catalog ID
STK453282
SMILES CCOC(=O)c1c(NC(=O)c2ccc(c(c2)[N+](=O)[O-])OC)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 C17H17N3O7S MW 407.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O7S/c1-4-27-17(23)12-8(2)13(14(18)21)28-16(12)19-15(22)9-5-6-11(26-3)10(7-9)20(24)25/h5-7H,4H2,1-3H3,(H2,18,21)(H,19,22)InChIKey
KEKJDLGXTVRLSS-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)C2=CC(=C(C=C2)OC)(N+)(=O)(O)
CCOC(=O)c1c(NC(=O)c2ccc(c(c2)(N+)(=O)(O))OC)sc(c1C)C(=O)N
ETHYL5(AMINOCARBONYL)2((3NITRO4METHOXYBENZOYL)AMINO)4METHYL3THIOPHENECARBOXYLATE
ethyl5carbamoyl2(((4methoxy3nitrophenyl)carbonyl)amino)4methylthiophene3carboxylate
ETHYL5CARBAMOYL2((4METHOXY3NITROBENZOYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL5CARBAMOYL2((4METHOXY3NITROPHENYL)CARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC17H17N3O7Sc142717(23)128(2)13(14(18)21)2816(12)1915(22)95611(263)10(79)20(24)25h57H4H213H3(H21821)(H1922)
MFCD02607703
ZINC000002102711
ZINC02102711
ZINC2102711
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