Vitas-M small molecule compound
methyl {[3-cyano-4-(4-ethoxyphenyl)-6-methyl-5-(phenylcarbamoyl)-1,4-dihydropyridin-2-yl]sulfanyl}acetate
Catalog ID
STK844300
SMILES CCOc1ccc(cc1)C1C(=C(C)NC(=C1C#N)SCC(=O)OC)C(=O)Nc1ccccc1
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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 C25H25N3O4S MW 463.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O4S/c1-4-32-19-12-10-17(11-13-19)23-20(14-26)25(33-15-21(29)31-3)27-16(2)22(23)24(30)28-18-8-6-5-7-9-18/h5-13,23,27H,4,15H2,1-3H3,(H,28,30)InChIKey
ANEADAQNMPQMMB-UHFFFAOYSA-NSynonyms
683794-06-1683794061
CCOC1=CC=C(C=C1)C2C(=C(NC(=C2C(=O)NC3=CC=CC=C3)C)SCC(=O)OC)C#N
InChI=1SC25H25N3O4Sc143219121017(111319)2320(1426)25(331521(29)313)2716(2)22(23)24(30)28188657918h5132327H415H213H3(H2830)
methyl((3cyano4(4ethoxyphenyl)6methyl5(phenylcarbamoyl)14dihydropyridin2yl)sulfanyl)acetate
METHYL2((3CYANO4(4ETHOXYPHENYL)6METHYL5(PHENYLCARBAMOYL)14DIHYDROPYRIDIN2YL)SULFANYL)ACETATE
METHYL2((3CYANO4(4ETHOXYPHENYL)6METHYL5(PHENYLCARBAMOYL)14DIHYDROPYRIDIN2YL)THIO)ACETATE
MFCD03674140
ZINC000020171162
ZINC000020171163
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