(3-methyl-1-benzothiophen-2-yl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (3-methyl-1-benzothiophen-2-yl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(3-methylbenzothiophen-2-yl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-(3-methyl-1-benzothiophen-2-yl)methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-(3-methyl-1-benzothiophen-2-yl)methanone Traditional Name: (4-besylpiperazino)-(3-methylbenzothiophen-2-yl)methanone Formula: C20H20N2O3S2 MolecularWeight: 400.5144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H20N2O3S2/c1-15-17-9-5-6-10-18(17)26-19(15)20(23)21-11-13-22(14-12-21)27(24,25)16-7-3-2-4-8-16/h2-10H,11-14H2,1H3