[2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]carbonylphenyl]-thiophen-2-yl-methanone

Systemtic Name: [2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]carbonylphenyl]-thiophen-2-yl-methanone Openeye Name: [2-(4-benzylsulfonylpiperazine-1-carbonyl)phenyl]-(2-thienyl)methanone CAS Name: [2-[oxo-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methyl]phenyl]-thiophen-2-ylmethanone IUPAC Name: [2-(4-benzylsulfonylpiperazine-1-carbonyl)phenyl]-thiophen-2-ylmethanone Traditional Name: [2-(4-benzylsulfonylpiperazine-1-carbonyl)phenyl]-(2-thienyl)methanone Formula: C23H22N2O4S2 MolecularWeight: 454.56178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=C2C(=O)C3=CC=CS3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=C2C(=O)C3=CC=CS3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H22N2O4S2/c26-22(21-11-6-16-30-21)19-9-4-5-10-20(19)23(27)24-12-14-25(15-13-24)31(28,29)17-18-7-2-1-3-8-18/h1-11,16H,12-15,17H2