(5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: (5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: (5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C18H22N2O3S3 MolecularWeight: 410.57388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1CCC2=C(C1)C=C(S2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C18H22N2O3S3/c1-13-4-5-15-14(11-13)12-16(25-15)18(21)19-6-8-20(9-7-19)26(22,23)17-3-2-10-24-17/h2-3,10,12-13H,4-9,11H2,1H3