(6-methoxy-3-phenylsulfanyl-1H-indol-2-yl)-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone

Systemtic Name: (6-methoxy-3-phenylsulfanyl-1H-indol-2-yl)-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone Openeye Name: (6-methoxy-3-phenylsulfanyl-1H-indol-2-yl)-[3-methyl-4-(m-tolyl)piperazin-1-yl]methanone CAS Name: [6-methoxy-3-(phenylthio)-1H-indol-2-yl]-[3-methyl-4-(3-methylphenyl)-1-piperazinyl]methanone IUPAC Name: (6-methoxy-3-phenylsulfanyl-1H-indol-2-yl)-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone Traditional Name: [6-methoxy-3-(phenylthio)-1H-indol-2-yl]-[3-methyl-4-(m-tolyl)piperazino]methanone Formula: C28H29N3O2S MolecularWeight: 471.61376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)C(=O)C3=C(C4=C(N3)C=C(C=C4)OC)SC5=CC=CC=C5

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)C(=O)C3=C(C4=C(N3)C=C(C=C4)OC)SC5=CC=CC=C5

InChI

InChI=1S/C28H29N3O2S/c1-19-8-7-9-21(16-19)31-15-14-30(18-20(31)2)28(32)26-27(34-23-10-5-4-6-11-23)24-13-12-22(33-3)17-25(24)29-26/h4-13,16-17,20,29H,14-15,18H2,1-3H3