4-(2-chlorophenyl)-2-[(4-chlorophenyl)methylsulfanyl]-5-ethanoyl-6-methyl-1,4-dihydropyridine-3-carbonitrile

Systemtic Name: 4-(2-chlorophenyl)-2-[(4-chlorophenyl)methylsulfanyl]-5-ethanoyl-6-methyl-1,4-dihydropyridine-3-carbonitrile Openeye Name: 5-acetyl-4-(2-chlorophenyl)-2-[(4-chlorophenyl)methylsulfanyl]-6-methyl-1,4-dihydropyridine-3-carbonitrile CAS Name: 5-acetyl-4-(2-chlorophenyl)-2-[(4-chlorophenyl)methylthio]-6-methyl-1,4-dihydropyridine-3-carbonitrile IUPAC Name: 5-acetyl-4-(2-chlorophenyl)-2-[(4-chlorophenyl)methylsulfanyl]-6-methyl-1,4-dihydropyridine-3-carbonitrile Traditional Name: 5-acetyl-2-[(4-chlorobenzyl)thio]-4-(2-chlorophenyl)-6-methyl-1,4-dihydropyridine-3-carbonitrile Formula: C22H18Cl2N2OS MolecularWeight: 429.36212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC2=CC=C(C=C2)Cl)C#N)C3=CC=CC=C3Cl)C(=O)C

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC2=CC=C(C=C2)Cl)C#N)C3=CC=CC=C3Cl)C(=O)C

InChI

InChI=1S/C22H18Cl2N2OS/c1-13-20(14(2)27)21(17-5-3-4-6-19(17)24)18(11-25)22(26-13)28-12-15-7-9-16(23)10-8-15/h3-10,21,26H,12H2,1-2H3