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

Systemtic Name: 4-(4-bromophenyl)-2-[2-(3,4-dichlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-5-ethanoyl-6-methyl-1,4-dihydropyridine-3-carbonitrile Openeye Name: 5-acetyl-4-(4-bromophenyl)-2-[2-(3,4-dichlorophenyl)-2-oxo-ethyl]sulfanyl-6-methyl-1,4-dihydropyridine-3-carbonitrile CAS Name: 5-acetyl-4-(4-bromophenyl)-2-[[2-(3,4-dichlorophenyl)-2-oxoethyl]thio]-6-methyl-1,4-dihydropyridine-3-carbonitrile IUPAC Name: 5-acetyl-4-(4-bromophenyl)-2-[2-(3,4-dichlorophenyl)-2-oxoethyl]sulfanyl-6-methyl-1,4-dihydropyridine-3-carbonitrile Traditional Name: 5-acetyl-4-(4-bromophenyl)-2-[[2-(3,4-dichlorophenyl)-2-keto-ethyl]thio]-6-methyl-1,4-dihydropyridine-3-carbonitrile Formula: C23H17BrCl2N2O2S MolecularWeight: 536.26828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)C2=CC(=C(C=C2)Cl)Cl)C#N)C3=CC=C(C=C3)Br)C(=O)C

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC(=O)C2=CC(=C(C=C2)Cl)Cl)C#N)C3=CC=C(C=C3)Br)C(=O)C

InChI

InChI=1S/C23H17BrCl2N2O2S/c1-12-21(13(2)29)22(14-3-6-16(24)7-4-14)17(10-27)23(28-12)31-11-20(30)15-5-8-18(25)19(26)9-15/h3-9,22,28H,11H2,1-2H3