Vitas-M small molecule compound
ethyl 2-{[(2E)-2-cyano-3-(1,3-dimethyl-1H-pyrazol-4-yl)prop-2-enoyl]amino}-5-(propan-2-yl)thiophene-3-carboxylate
Catalog ID
STK473603
SMILES CCOC(=O)c1cc(sc1NC(=O)/C(=C/c1cn(nc1C)C)/C#N)C(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 C19H22N4O3S MW 386.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N4O3S/c1-6-26-19(25)15-8-16(11(2)3)27-18(15)21-17(24)13(9-20)7-14-10-23(5)22-12(14)4/h7-8,10-11H,6H2,1-5H3,(H,21,24)/b13-7+InChIKey
YAOWZWPTSZYXKR-NTUHNPAUSA-NSynonyms
CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)C(=CC2=CN(N=C2C)C)C#N
CCOC(=O)c1cc(sc1NC(=O)C(=Cc1cn(nc1C)C)C#N)C(C)C
ethyl2(((2E)2cyano3(13dimethyl1Hpyrazol4yl)prop2enoyl)amino)5(propan2yl)thiophene3carboxylate
ethyl2(((E)2cyano3(13dimethylpyrazol4yl)prop2enoyl)amino)5propan2ylthiophene3carboxylate
ETHYL2((2E)3(13DIMETHYLPYRAZOL4YL)2CYANOPROP2ENOYLAMINO)5(METHYLETHYL)THIOPHENE3CARBOXYLATE
InChI=1SC19H22N4O3Sc162619(25)15816(11(2)3)2718(15)2117(24)13(920)7141023(5)2212(14)4h781011H6H215H3(H2124)b137+
MFCD07077921
ZINC000017078913
ZINC17078913
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