1-[4-[4-(1-benzothiophen-2-ylcarbonyl)piperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[4-[4-(1-benzothiophen-2-ylcarbonyl)piperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[4-[4-(benzothiophene-2-carbonyl)piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[4-[[4-[1-benzothiophen-2-yl(oxo)methyl]-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(1-benzothiophene-2-carbonyl)piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[4-[4-(benzothiophene-2-carbonyl)piperazino]sulfonylphenyl]ethanone Formula: C21H20N2O4S2 MolecularWeight: 428.5245

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4S3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C21H20N2O4S2/c1-15(24)16-6-8-18(9-7-16)29(26,27)23-12-10-22(11-13-23)21(25)20-14-17-4-2-3-5-19(17)28-20/h2-9,14H,10-13H2,1H3