4-(2-chlorophenyl)-5-ethanoyl-6-methyl-2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-1,4-dihydropyridine-3-carbonitrile

Systemtic Name: 4-(2-chlorophenyl)-5-ethanoyl-6-methyl-2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-1,4-dihydropyridine-3-carbonitrile Openeye Name: 5-acetyl-4-(2-chlorophenyl)-6-methyl-2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-1,4-dihydropyridine-3-carbonitrile CAS Name: 5-acetyl-4-(2-chlorophenyl)-6-methyl-2-[[2-oxo-2-(4-phenylphenyl)ethyl]thio]-1,4-dihydropyridine-3-carbonitrile IUPAC Name: 5-acetyl-4-(2-chlorophenyl)-6-methyl-2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-1,4-dihydropyridine-3-carbonitrile Traditional Name: 5-acetyl-4-(2-chlorophenyl)-2-[[2-keto-2-(4-phenylphenyl)ethyl]thio]-6-methyl-1,4-dihydropyridine-3-carbonitrile Formula: C29H23ClN2O2S MolecularWeight: 499.02312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C#N)C4=CC=CC=C4Cl)C(=O)C

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3)C#N)C4=CC=CC=C4Cl)C(=O)C

InChI

InChI=1S/C29H23ClN2O2S/c1-18-27(19(2)33)28(23-10-6-7-11-25(23)30)24(16-31)29(32-18)35-17-26(34)22-14-12-21(13-15-22)20-8-4-3-5-9-20/h3-15,28,32H,17H2,1-2H3