N-(4-bromophenyl)-2-[[4-(4-chlorophenyl)-3-cyano-5-ethanoyl-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[[4-(4-chlorophenyl)-3-cyano-5-ethanoyl-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-acetyl-4-(4-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]-N-(4-bromophenyl)acetamide CAS Name: 2-[[5-acetyl-4-(4-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]thio]-N-(4-bromophenyl)acetamide IUPAC Name: 2-[[5-acetyl-4-(4-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]sulfanyl]-N-(4-bromophenyl)acetamide Traditional Name: 2-[[5-acetyl-4-(4-chlorophenyl)-3-cyano-6-methyl-1,4-dihydropyridin-2-yl]thio]-N-(4-bromophenyl)acetamide Formula: C23H19BrClN3O2S MolecularWeight: 516.83786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=C(C=C2)Br)C#N)C3=CC=C(C=C3)Cl)C(=O)C

Isomeric SMILES

CC1=C(C(C(=C(N1)SCC(=O)NC2=CC=C(C=C2)Br)C#N)C3=CC=C(C=C3)Cl)C(=O)C

InChI

InChI=1S/C23H19BrClN3O2S/c1-13-21(14(2)29)22(15-3-7-17(25)8-4-15)19(11-26)23(27-13)31-12-20(30)28-18-9-5-16(24)6-10-18/h3-10,22,27H,12H2,1-2H3,(H,28,30)