[3-(4-chlorophenyl)sulfanyl-6-methyl-1H-indol-2-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone

Systemtic Name: [3-(4-chlorophenyl)sulfanyl-6-methyl-1H-indol-2-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: (4-benzyl-1-piperidyl)-[3-(4-chlorophenyl)sulfanyl-6-methyl-1H-indol-2-yl]methanone CAS Name: [3-[(4-chlorophenyl)thio]-6-methyl-1H-indol-2-yl]-[4-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-[3-(4-chlorophenyl)sulfanyl-6-methyl-1H-indol-2-yl]methanone Traditional Name: (4-benzylpiperidino)-[3-[(4-chlorophenyl)thio]-6-methyl-1H-indol-2-yl]methanone Formula: C28H27ClN2OS MolecularWeight: 475.04478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(N2)C(=O)N3CCC(CC3)CC4=CC=CC=C4)SC5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(N2)C(=O)N3CCC(CC3)CC4=CC=CC=C4)SC5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H27ClN2OS/c1-19-7-12-24-25(17-19)30-26(27(24)33-23-10-8-22(29)9-11-23)28(32)31-15-13-21(14-16-31)18-20-5-3-2-4-6-20/h2-12,17,21,30H,13-16,18H2,1H3