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

Systemtic Name: (5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methanone Traditional Name: (4-besylpiperazino)-(5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)methanone Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N2O3S2/c1-15-7-8-18-16(13-15)14-19(26-18)20(23)21-9-11-22(12-10-21)27(24,25)17-5-3-2-4-6-17/h2-6,14-15H,7-13H2,1H3