4-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-1-(4-phenylphenyl)-2-sulfanyl-butan-1-one

Systemtic Name: 4-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]-1-(4-phenylphenyl)-2-sulfanyl-butan-1-one Openeye Name: 4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]-1-(4-phenylphenyl)-2-sulfanyl-butan-1-one CAS Name: 4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]-2-mercapto-1-(4-phenylphenyl)-1-butanone IUPAC Name: 4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]-1-(4-phenylphenyl)-2-sulfanylbutan-1-one Traditional Name: 4-[4-(4-chlorophenyl)-4-hydroxy-piperidino]-2-mercapto-1-(4-phenylphenyl)butan-1-one Formula: C27H28ClNO2S MolecularWeight: 466.03472

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCC(C(=O)C3=CC=C(C=C3)C4=CC=CC=C4)S

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCC(C(=O)C3=CC=C(C=C3)C4=CC=CC=C4)S

InChI

InChI=1S/C27H28ClNO2S/c28-24-12-10-23(11-13-24)27(31)15-18-29(19-16-27)17-14-25(32)26(30)22-8-6-21(7-9-22)20-4-2-1-3-5-20/h1-13,25,31-32H,14-19H2