Vitas-M small molecule compound
5-cyano-6-({2-[(4-ethoxyphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Catalog ID
STK763774
SMILES CCOc1ccc(cc1)NC(=O)CSC1=C(C#N)C(C(=C(N1)C)C(=O)Nc1ccccc1C)c1cccs1
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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 C29H28N4O3S2 MW 544.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O3S2/c1-4-36-21-13-11-20(12-14-21)32-25(34)17-38-29-22(16-30)27(24-10-7-15-37-24)26(19(3)31-29)28(35)33-23-9-6-5-8-18(23)2/h5-15,27,31H,4,17H2,1-3H3,(H,32,34)(H,33,35)InChIKey
KZYBSELQLYBLJJ-UHFFFAOYSA-NSynonyms
2(3CYANO6METHYL5(N(2METHYLPHENYL)CARBAMOYL)4(2THIENYL)(214DIHYDROPYRIDYLTHIO))N(4ETHOXYPHENYL)ACETAMIDE
5cyano6((2((4ethoxyphenyl)amino)2oxoethyl)sulfanyl)2methylN(2methylphenyl)4(thiophen2yl)14dihydropyridine3carboxamide
5CYANO6((2((4ETHOXYPHENYL)AMINO)2OXOETHYL)SULFANYL)2METHYLN(2METHYLPHENYL)4THIOPHEN2YL14DIHYDROPYRIDINE3CARBOXAMIDE
5cyano6((2((4ethoxyphenyl)amino)2oxoethyl)thio)2methyl4(thiophen2yl)N(otolyl)14dihydropyridine3carboxamide
5CYANO6(2(4ETHOXYANILINO)2OXOETHYL)SULFANYL2METHYLN(2METHYLPHENYL)4THIOPHEN2YL14DIHYDROPYRIDINE3CARBOXAMIDE
CCOC1=CC=C(C=C1)NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)NC3=CC=CC=C3C)C4=CC=CS4)C#N
InChI=1SC29H28N4O3S2c143621131120(121421)3225(34)17382922(1630)27(24107153724)26(19(3)3129)28(35)3323965818(23)2h5152731H417H213H3(H3234)(H3335)
MFCD02238846
ZINC000097950481
ZINC000097950482
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