Vitas-M small molecule compound
methyl 2-({(2E)-2-cyano-3-[4-(pentyloxy)phenyl]prop-2-enoyl}amino)-5-propylthiophene-3-carboxylate
Catalog ID
STK472821
SMILES CCCCCOc1ccc(cc1)/C=C(/C(=O)Nc1sc(cc1C(=O)OC)CCC)\C#N
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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 C24H28N2O4S MW 440.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O4S/c1-4-6-7-13-30-19-11-9-17(10-12-19)14-18(16-25)22(27)26-23-21(24(28)29-3)15-20(31-23)8-5-2/h9-12,14-15H,4-8,13H2,1-3H3,(H,26,27)/b18-14+InChIKey
BPAAVKGFAVTLAW-NBVRZTHBSA-NSynonyms
CCCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C=C(S2)CCC)C(=O)OC
CCCCCOc1ccc(cc1)C=C(C(=O)Nc1sc(cc1C(=O)OC)CCC)C#N
InChI=1SC24H28N2O4Sc146713301911917(101219)1418(1625)22(27)262321(24(28)293)1520(3123)852h9121415H4813H213H3(H2627)b1814+
methyl2(((2E)2cyano3(4(pentyloxy)phenyl)prop2enoyl)amino)5propylthiophene3carboxylate
methyl2(((E)2cyano3(4pentoxyphenyl)prop2enoyl)amino)5propylthiophene3carboxylate
METHYL2((2E)2CYANO3(4PENTYLOXYPHENYL)PROP2ENOYLAMINO)5PROPYLTHIOPHENE3CARBOXYLATE
MFCD07091699
ZINC000019632192
ZINC19632192
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