[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-[4-(quinolin-2-ylsulfanylmethyl)phenyl]methanone

Systemtic Name: [4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-[4-(quinolin-2-ylsulfanylmethyl)phenyl]methanone Openeye Name: [4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-[4-(2-quinolylsulfanylmethyl)phenyl]methanone CAS Name: [4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-[4-[(2-quinolinylthio)methyl]phenyl]methanone IUPAC Name: [4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-[4-(quinolin-2-ylsulfanylmethyl)phenyl]methanone Traditional Name: [4-(4-chlorophenyl)-4-hydroxy-piperidino]-[4-[(2-quinolylthio)methyl]phenyl]methanone Formula: C28H25ClN2O2S MolecularWeight: 489.0283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)C(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)C(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C28H25ClN2O2S/c29-24-12-10-23(11-13-24)28(33)15-17-31(18-16-28)27(32)22-7-5-20(6-8-22)19-34-26-14-9-21-3-1-2-4-25(21)30-26/h1-14,33H,15-19H2