Vitas-M small molecule compound
ethyl 6-cyano-2-{[(4-methoxyphenyl)carbonyl]amino}-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK004190
SMILES CCOC(=O)c1c(NC(=O)c2ccc(cc2)OC)sc2c1CCC(C2)(C#N)c1ccccc1
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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 C26H24N2O4S MW 460.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N2O4S/c1-3-32-25(30)22-20-13-14-26(16-27,18-7-5-4-6-8-18)15-21(20)33-24(22)28-23(29)17-9-11-19(31-2)12-10-17/h4-12H,3,13-15H2,1-2H3,(H,28,29)InChIKey
PPWMUQZDTAQAON-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCC(C2)(C#N)C3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)OC
CCOC(=O)c1c(NC(=O)c2ccc(cc2)OC)sc2c1CCC(C2)(C#N)c1ccccc1
ethyl6cyano2(((4methoxyphenyl)carbonyl)amino)6phenyl4567tetrahydro1benzothiophene3carboxylate
ETHYL6CYANO2((4METHOXYBENZOYL)AMINO)6PHENYL57DIHYDRO4H1BENZOTHIOPHENE3CARBOXYLATE
InChI=1SC26H24N2O4Sc133225(30)2220131426(1627187546818)1521(20)3324(22)2823(29)1791119(312)121017h412H31315H212H3(H2829)
MFCD02642350
STK004190
ZINC000008951942
ZINC000009860893
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