[4-(3-methylphenyl)piperazin-1-yl]-(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone

Systemtic Name: [4-(3-methylphenyl)piperazin-1-yl]-(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone Openeye Name: (5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-[4-(m-tolyl)piperazin-1-yl]methanone CAS Name: [4-(3-methylphenyl)-1-piperazinyl]-(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone IUPAC Name: [4-(3-methylphenyl)piperazin-1-yl]-(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone Traditional Name: (5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-[4-(m-tolyl)piperazino]methanone Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C

InChI

InChI=1S/C21H26N2OS/c1-15-4-3-5-18(13-15)22-8-10-23(11-9-22)21(24)20-14-17-12-16(2)6-7-19(17)25-20/h3-5,13-14,16H,6-12H2,1-2H3