[1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl] 4-methyl-3-[(4-methylphenyl)sulfamoyl]benzoate

Systemtic Name: [1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-1-oxidanylidene-propan-2-yl] 4-methyl-3-[(4-methylphenyl)sulfamoyl]benzoate Openeye Name: [2-[4-(furan-2-carbonyl)piperazin-1-yl]-1-methyl-2-oxo-ethyl] 4-methyl-3-(p-tolylsulfamoyl)benzoate CAS Name: 4-methyl-3-[(4-methylphenyl)sulfamoyl]benzoic acid [1-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-1-oxopropan-2-yl] ester IUPAC Name: [1-[4-(furan-2-carbonyl)piperazin-1-yl]-1-oxopropan-2-yl] 4-methyl-3-[(4-methylphenyl)sulfamoyl]benzoate Traditional Name: 4-methyl-3-(p-tolylsulfamoyl)benzoic acid [2-[4-(2-furoyl)piperazino]-2-keto-1-methyl-ethyl] ester Formula: C27H29N3O7S MolecularWeight: 539.60006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OC(C)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4)C

Isomeric SMILES

CC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OC(C)C(=O)N3CCN(CC3)C(=O)C4=CC=CO4)C

InChI

InChI=1S/C27H29N3O7S/c1-18-6-10-22(11-7-18)28-38(34,35)24-17-21(9-8-19(24)2)27(33)37-20(3)25(31)29-12-14-30(15-13-29)26(32)23-5-4-16-36-23/h4-11,16-17,20,28H,12-15H2,1-3H3