(4,5-dimethylthiophen-2-yl)-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (4,5-dimethylthiophen-2-yl)-[4-(phenylmethyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-benzylsulfonylpiperazin-1-yl)-(4,5-dimethyl-2-thienyl)methanone CAS Name: (4,5-dimethyl-2-thiophenyl)-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-benzylsulfonylpiperazin-1-yl)-(4,5-dimethylthiophen-2-yl)methanone Traditional Name: (4-benzylsulfonylpiperazino)-(4,5-dimethyl-2-thienyl)methanone Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3)C

InChI

InChI=1S/C18H22N2O3S2/c1-14-12-17(24-15(14)2)18(21)19-8-10-20(11-9-19)25(22,23)13-16-6-4-3-5-7-16/h3-7,12H,8-11,13H2,1-2H3