Vitas-M small molecule compound
ethyl (5Z)-2-[(4-nitrophenyl)amino]-4-oxo-5-(pyridin-3-ylmethylidene)-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK042052
SMILES CCOC(=O)C1=C(Nc2ccc(cc2)[N+](=O)[O-])S/C(=C\c2cccnc2)/C1=O
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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 C19H15N3O5S MW 397.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N3O5S/c1-2-27-19(24)16-17(23)15(10-12-4-3-9-20-11-12)28-18(16)21-13-5-7-14(8-6-13)22(25)26/h3-11,21H,2H2,1H3/b15-10-InChIKey
VSESRUQHJCSXPN-GDNBJRDFSA-NSynonyms
297160-59-9297160599
CCOC(=O)C1=C(Nc2ccc(cc2)(N+)(=O)(O))SC(=Cc2cccnc2)C1=O
CCOC(=O)C1=C(SC(=CC2=CN=CC=C2)C1=O)NC3=CC=C(C=C3)(N+)(=O)(O)
ETHYL(5Z)2((4NITROPHENYL)AMINO)4OXO5(PYRIDIN3YLMETHYLIDENE)45DIHYDROTHIOPHENE3CARBOXYLATE
ETHYL(5Z)2(4NITROANILINO)4OXO5(PYRIDIN3YLMETHYLIDENE)THIOPHENE3CARBOXYLATE
InChI=1SC19H15N3O5Sc122719(24)1617(23)15(1012439201112)2818(16)21135714(8613)22(25)26h31121H2H21H3b1510
MFCD02108371
STK042052
ZINC000004608503
ZINC04608503
ZINC4608503
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