Vitas-M small molecule compound
ethyl 2-{[(2E)-3-(4-chlorophenyl)prop-2-enoyl]amino}-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate
Catalog ID
STK418826
SMILES CCOC(=O)c1c(NC(=O)/C=C/c2ccc(cc2)Cl)sc(c1C)C(=O)N(CC)CC
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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 C22H25ClN2O4S MW 448.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN2O4S/c1-5-25(6-2)21(27)19-14(4)18(22(28)29-7-3)20(30-19)24-17(26)13-10-15-8-11-16(23)12-9-15/h8-13H,5-7H2,1-4H3,(H,24,26)/b13-10+InChIKey
KCHJKBABEULGKB-JLHYYAGUSA-NSynonyms
354995-19-0354995190
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C=CC2=CC=C(C=C2)Cl)C(=O)OCC)C
CCOC(=O)c1c(NC(=O)C=Cc2ccc(cc2)Cl)sc(c1C)C(=O)N(CC)CC
ethyl2(((2E)3(4chlorophenyl)prop2enoyl)amino)5(diethylcarbamoyl)4methylthiophene3carboxylate
ETHYL2(((E)3(4CHLOROPHENYL)PROP2ENOYL)AMINO)5(DIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2((3(4CHLOROPHENYL)ACRYLOYL)AMINO)5((DIETHYLAMINO)CARBONYL)4METHYL3THIOPHENECARBOXYLATE
InChI=1SC22H25ClN2O4Sc1525(62)21(27)1914(4)18(22(28)2973)20(3019)2417(26)13101581116(23)12915h813H57H214H3(H2426)b1310+
MFCD01345817
ZINC000000995902
ZINC00995902
ZINC995902
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