N3,N5-bis(3-chlorophenyl)-2,6-dimethyl-4-(2-methylsulfanyl-3-phenylazanyl-imidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxamide

Systemtic Name: N3,N5-bis(3-chlorophenyl)-2,6-dimethyl-4-(2-methylsulfanyl-3-phenylazanyl-imidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxamide Openeye Name: 4-(3-anilino-2-methylsulfanyl-imidazol-4-yl)-N3,N5-bis(3-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxamide CAS Name: 4-[3-anilino-2-(methylthio)-4-imidazolyl]-N3,N5-bis(3-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxamide IUPAC Name: 4-(3-anilino-2-methylsulfanylimidazol-4-yl)-3-N,5-N-bis(3-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxamide Traditional Name: 4-[3-anilino-2-(methylthio)imidazol-4-yl]-N,N'-bis(3-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxamide Formula: C31H28Cl2N6O2S MolecularWeight: 619.56402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)NC2=CC(=CC=C2)Cl)C3=CN=C(N3NC4=CC=CC=C4)SC)C(=O)NC5=CC(=CC=C5)Cl

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)NC2=CC(=CC=C2)Cl)C3=CN=C(N3NC4=CC=CC=C4)SC)C(=O)NC5=CC(=CC=C5)Cl

InChI

InChI=1S/C31H28Cl2N6O2S/c1-18-26(29(40)36-23-13-7-9-20(32)15-23)28(25-17-34-31(42-3)39(25)38-22-11-5-4-6-12-22)27(19(2)35-18)30(41)37-24-14-8-10-21(33)16-24/h4-17,28,35,38H,1-3H3,(H,36,40)(H,37,41)