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

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

CCC1=CC=C(C=C1)C(=O)CSC2=C(C(C(=C(N2)C)C(=O)C)C3=CC=CC=C3Cl)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CSC2=C(C(C(=C(N2)C)C(=O)C)C3=CC=CC=C3Cl)C#N

InChI

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