Vitas-M small molecule compound
ethyl 2-({(2E)-2-cyano-3-[4-(pentyloxy)phenyl]prop-2-enoyl}amino)thiophene-3-carboxylate
Catalog ID
STK473556
SMILES CCCCCOc1ccc(cc1)/C=C(/C(=O)Nc1sccc1C(=O)OCC)\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 C22H24N2O4S MW 412.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O4S/c1-3-5-6-12-28-18-9-7-16(8-10-18)14-17(15-23)20(25)24-21-19(11-13-29-21)22(26)27-4-2/h7-11,13-14H,3-6,12H2,1-2H3,(H,24,25)/b17-14+InChIKey
RHYWXSUNUIGQNF-SAPNQHFASA-NSynonyms
CCCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C=CS2)C(=O)OCC
CCCCCOc1ccc(cc1)C=C(C(=O)Nc1sccc1C(=O)OCC)C#N
ethyl2(((2E)2cyano3(4(pentyloxy)phenyl)prop2enoyl)amino)thiophene3carboxylate
ethyl2(((E)2cyano3(4pentoxyphenyl)prop2enoyl)amino)thiophene3carboxylate
ETHYL2((2E)2CYANO3(4PENTYLOXYPHENYL)PROP2ENOYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC22H24N2O4Sc13561228189716(81018)1417(1523)20(25)242119(11132921)22(26)2742h7111314H3612H212H3(H2425)b1714+
MFCD07093295
ZINC000017089189
ZINC17089189
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