[3-(4-chlorophenyl)sulfanyl-1H-indol-2-yl]-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone

Systemtic Name: [3-(4-chlorophenyl)sulfanyl-1H-indol-2-yl]-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone Openeye Name: [3-(4-chlorophenyl)sulfanyl-1H-indol-2-yl]-[3-methyl-4-(m-tolyl)piperazin-1-yl]methanone CAS Name: [3-[(4-chlorophenyl)thio]-1H-indol-2-yl]-[3-methyl-4-(3-methylphenyl)-1-piperazinyl]methanone IUPAC Name: [3-(4-chlorophenyl)sulfanyl-1H-indol-2-yl]-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone Traditional Name: [3-[(4-chlorophenyl)thio]-1H-indol-2-yl]-[3-methyl-4-(m-tolyl)piperazino]methanone Formula: C27H26ClN3OS MolecularWeight: 476.03284

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=CC(=C2)C)C(=O)C3=C(C4=CC=CC=C4N3)SC5=CC=C(C=C5)Cl

Isomeric SMILES

CC1CN(CCN1C2=CC=CC(=C2)C)C(=O)C3=C(C4=CC=CC=C4N3)SC5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H26ClN3OS/c1-18-6-5-7-21(16-18)31-15-14-30(17-19(31)2)27(32)25-26(23-8-3-4-9-24(23)29-25)33-22-12-10-20(28)11-13-22/h3-13,16,19,29H,14-15,17H2,1-2H3