3-(4-methylphenyl)sulfonyl-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(4-methylphenyl)sulfonyl-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)propan-1-one Openeye Name: 3-(p-tolylsulfonyl)-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]propan-1-one CAS Name: 3-(4-methylphenyl)sulfonyl-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-methylphenyl)sulfonyl-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]propan-1-one Traditional Name: 1-[4-(2-thenoyl)piperazino]-3-tosyl-propan-1-one Formula: C19H22N2O4S2 MolecularWeight: 406.51898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)N2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C19H22N2O4S2/c1-15-4-6-16(7-5-15)27(24,25)14-8-18(22)20-9-11-21(12-10-20)19(23)17-3-2-13-26-17/h2-7,13H,8-12,14H2,1H3