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

Systemtic Name: 4-(2-chlorophenyl)-2-[2-(2,4-dimethylphenyl)-2-oxidanylidene-ethyl]sulfanyl-5-ethanoyl-6-methyl-1,4-dihydropyridine-3-carbonitrile Openeye Name: 5-acetyl-4-(2-chlorophenyl)-2-[2-(2,4-dimethylphenyl)-2-oxo-ethyl]sulfanyl-6-methyl-1,4-dihydropyridine-3-carbonitrile CAS Name: 5-acetyl-4-(2-chlorophenyl)-2-[[2-(2,4-dimethylphenyl)-2-oxoethyl]thio]-6-methyl-1,4-dihydropyridine-3-carbonitrile IUPAC Name: 5-acetyl-4-(2-chlorophenyl)-2-[2-(2,4-dimethylphenyl)-2-oxoethyl]sulfanyl-6-methyl-1,4-dihydropyridine-3-carbonitrile Traditional Name: 5-acetyl-4-(2-chlorophenyl)-2-[[2-(2,4-dimethylphenyl)-2-keto-ethyl]thio]-6-methyl-1,4-dihydropyridine-3-carbonitrile Formula: C25H23ClN2O2S MolecularWeight: 450.98032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)CSC2=C(C(C(=C(N2)C)C(=O)C)C3=CC=CC=C3Cl)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)CSC2=C(C(C(=C(N2)C)C(=O)C)C3=CC=CC=C3Cl)C#N)C

InChI

InChI=1S/C25H23ClN2O2S/c1-14-9-10-18(15(2)11-14)22(30)13-31-25-20(12-27)24(19-7-5-6-8-21(19)26)23(17(4)29)16(3)28-25/h5-11,24,28H,13H2,1-4H3