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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=C(C4=C(N3)C=C(C=C4)OC)SC5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=C(C4=C(N3)C=C(C=C4)OC)SC5=CC=CC=C5)C

InChI

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