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

Systemtic Name: (4-methylphenyl)-[4-(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonyl)piperazin-1-yl]methanone Openeye Name: p-tolyl-[4-(4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)piperazin-1-yl]methanone CAS Name: (4-methylphenyl)-[4-[oxo(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methyl]-1-piperazinyl]methanone IUPAC Name: (4-methylphenyl)-[4-(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonyl)piperazin-1-yl]methanone Traditional Name: p-tolyl-[4-(4,5,6,7-tetrahydrobenzothiophene-2-carbonyl)piperazino]methanone Formula: C21H24N2O2S MolecularWeight: 368.49246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC4=C(S3)CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC4=C(S3)CCCC4

InChI

InChI=1S/C21H24N2O2S/c1-15-6-8-16(9-7-15)20(24)22-10-12-23(13-11-22)21(25)19-14-17-4-2-3-5-18(17)26-19/h6-9,14H,2-5,10-13H2,1H3