[2-(4-chlorophenyl)sulfanylquinolin-4-yl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [2-(4-chlorophenyl)sulfanylquinolin-4-yl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: [2-(4-chlorophenyl)sulfanyl-4-quinolyl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [2-[(4-chlorophenyl)thio]-4-quinolinyl]-[4-(4-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [2-(4-chlorophenyl)sulfanylquinolin-4-yl]-[4-(4-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [2-[(4-chlorophenyl)thio]-4-quinolyl]-[4-(4-methoxyphenyl)piperazino]methanone Formula: C27H24ClN3O2S MolecularWeight: 490.01636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)SC5=CC=C(C=C5)Cl

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)SC5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H24ClN3O2S/c1-33-21-10-8-20(9-11-21)30-14-16-31(17-15-30)27(32)24-18-26(29-25-5-3-2-4-23(24)25)34-22-12-6-19(28)7-13-22/h2-13,18H,14-17H2,1H3