Vitas-M small molecule compound
ethyl 5-methyl-2-{[(2-methyl-3-nitrophenyl)carbonyl]amino}thiophene-3-carboxylate
Catalog ID
STK452563
SMILES CCOC(=O)c1cc(sc1NC(=O)c1cccc(c1C)[N+](=O)[O-])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 C16H16N2O5S MW 348.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O5S/c1-4-23-16(20)12-8-9(2)24-15(12)17-14(19)11-6-5-7-13(10(11)3)18(21)22/h5-8H,4H2,1-3H3,(H,17,19)InChIKey
KHIZBCOAJQRUPS-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1)C)NC(=O)C2=C(C(=CC=C2)(N+)(=O)(O))C
CCOC(=O)c1cc(sc1NC(=O)c1cccc(c1C)(N+)(=O)(O))C
ETHYL2((3NITRO2METHYLBENZOYL)AMINO)5METHYLTHIOPHENE3CARBOXYLATE
ethyl5methyl2(((2methyl3nitrophenyl)carbonyl)amino)thiophene3carboxylate
ETHYL5METHYL2((2METHYL3NITROBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
ETHYL5METHYL2((2METHYL3NITROPHENYL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC16H16N2O5Sc142316(20)1289(2)2415(12)1714(19)1165713(10(11)3)18(21)22h58H4H213H3(H1719)
MFCD02607620
ZINC000000371355
ZINC00371355
ZINC371355
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