4-(3-chlorophenyl)-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-1-methyl-quinoline-2-thione

Systemtic Name: 4-(3-chlorophenyl)-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-1-methyl-quinoline-2-thione Openeye Name: 4-(3-chlorophenyl)-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-1-methyl-quinoline-2-thione CAS Name: 4-(3-chlorophenyl)-6-[(4-chlorophenyl)-(3-methyl-4-imidazolyl)methyl]-1-methyl-2-quinolinethione IUPAC Name: 4-(3-chlorophenyl)-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-1-methylquinoline-2-thione Traditional Name: 4-(3-chlorophenyl)-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)methyl]-1-methyl-quinoline-2-thione Formula: C27H21Cl2N3S MolecularWeight: 490.44674

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(C2=CC=C(C=C2)Cl)C3=CC4=C(C=C3)N(C(=S)C=C4C5=CC(=CC=C5)Cl)C

Isomeric SMILES

CN1C=NC=C1C(C2=CC=C(C=C2)Cl)C3=CC4=C(C=C3)N(C(=S)C=C4C5=CC(=CC=C5)Cl)C

InChI

InChI=1S/C27H21Cl2N3S/c1-31-16-30-15-25(31)27(17-6-9-20(28)10-7-17)19-8-11-24-23(13-19)22(14-26(33)32(24)2)18-4-3-5-21(29)12-18/h3-16,27H,1-2H3