Vitas-M small molecule compound
propan-2-yl 4-cyano-3-methyl-5-{[(2E)-3-(4-nitrophenyl)prop-2-enoyl]amino}thiophene-2-carboxylate
Catalog ID
STK333421
SMILES N#Cc1c(NC(=O)/C=C/c2ccc(cc2)[N+](=O)[O-])sc(c1C)C(=O)OC(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 C19H17N3O5S MW 399.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N3O5S/c1-11(2)27-19(24)17-12(3)15(10-20)18(28-17)21-16(23)9-6-13-4-7-14(8-5-13)22(25)26/h4-9,11H,1-3H3,(H,21,23)/b9-6+InChIKey
ZNCLOVWGTHGECG-RMKNXTFCSA-NSynonyms
CC1=C(SC(=C1C#N)NC(=O)C=CC2=CC=C(C=C2)(N+)(=O)(O))C(=O)OC(C)C
InChI=1SC19H17N3O5Sc111(2)2719(24)1712(3)15(1020)18(2817)2116(23)96134714(8513)22(25)26h4911H13H3(H2123)b96+
ISOPROPYL4CYANO5((3(4NITROPHENYL)ACRYLOYL)AMINO)3METHYL2THIOPHENECARBOXYLATE
METHYLETHYL5((2E)3(4NITROPHENYL)PROP2ENOYLAMINO)4CYANO3METHYLTHIOPHENE2CARBOXYLATE
MFCD01337903
N#Cc1c(NC(=O)C=Cc2ccc(cc2)(N+)(=O)(O))sc(c1C)C(=O)OC(C)C
propan2yl4cyano3methyl5(((2E)3(4nitrophenyl)prop2enoyl)amino)thiophene2carboxylate
PROPAN2YL4CYANO3METHYL5(((E)3(4NITROPHENYL)PROP2ENOYL)AMINO)THIOPHENE2CARBOXYLATE
ZINC000002081540
ZINC02081540
ZINC2081540
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