[3-(4-chlorophenyl)sulfanyl-1H-indol-2-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone

Systemtic Name: [3-(4-chlorophenyl)sulfanyl-1H-indol-2-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: (4-benzyl-1-piperidyl)-[3-(4-chlorophenyl)sulfanyl-1H-indol-2-yl]methanone CAS Name: [3-[(4-chlorophenyl)thio]-1H-indol-2-yl]-[4-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-[3-(4-chlorophenyl)sulfanyl-1H-indol-2-yl]methanone Traditional Name: (4-benzylpiperidino)-[3-[(4-chlorophenyl)thio]-1H-indol-2-yl]methanone Formula: C27H25ClN2OS MolecularWeight: 461.0182

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=C(C4=CC=CC=C4N3)SC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=C(C4=CC=CC=C4N3)SC5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H25ClN2OS/c28-21-10-12-22(13-11-21)32-26-23-8-4-5-9-24(23)29-25(26)27(31)30-16-14-20(15-17-30)18-19-6-2-1-3-7-19/h1-13,20,29H,14-18H2