5-cyano-4-(4-hydroxyphenyl)-2-methyl-N-phenyl-6-(phenylmethylsulfanyl)-1,4-dihydropyridine-3-carboxamide

Systemtic Name: 5-cyano-4-(4-hydroxyphenyl)-2-methyl-N-phenyl-6-(phenylmethylsulfanyl)-1,4-dihydropyridine-3-carboxamide Openeye Name: 6-benzylsulfanyl-5-cyano-4-(4-hydroxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide CAS Name: 5-cyano-4-(4-hydroxyphenyl)-2-methyl-N-phenyl-6-(phenylmethylthio)-1,4-dihydropyridine-3-carboxamide IUPAC Name: 6-benzylsulfanyl-5-cyano-4-(4-hydroxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Traditional Name: 6-(benzylthio)-5-cyano-4-(4-hydroxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide Formula: C27H23N3O2S MolecularWeight: 453.55542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC2=CC=CC=C2)C#N)C3=CC=C(C=C3)O)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC2=CC=CC=C2)C#N)C3=CC=C(C=C3)O)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C27H23N3O2S/c1-18-24(26(32)30-21-10-6-3-7-11-21)25(20-12-14-22(31)15-13-20)23(16-28)27(29-18)33-17-19-8-4-2-5-9-19/h2-15,25,29,31H,17H2,1H3,(H,30,32)