[2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-2-oxidanylidene-ethyl] 2-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]benzoate

Systemtic Name: [2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-2-oxidanylidene-ethyl] 2-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]benzoate Openeye Name: [2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxo-ethyl] 2-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]benzoate CAS Name: 2-[(5-tert-butyl-2-methylphenyl)sulfonylamino]benzoic acid [2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl] 2-[(5-tert-butyl-2-methylphenyl)sulfonylamino]benzoate Traditional Name: 2-[(5-tert-butyl-2-methyl-phenyl)sulfonylamino]benzoic acid [2-[4-(2-furoyl)piperazino]-2-keto-ethyl] ester Formula: C29H33N3O7S MolecularWeight: 567.65322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC2=CC=CC=C2C(=O)OCC(=O)N3CCN(CC3)C(=O)C4=CC=CO4

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NC2=CC=CC=C2C(=O)OCC(=O)N3CCN(CC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C29H33N3O7S/c1-20-11-12-21(29(2,3)4)18-25(20)40(36,37)30-23-9-6-5-8-22(23)28(35)39-19-26(33)31-13-15-32(16-14-31)27(34)24-10-7-17-38-24/h5-12,17-18,30H,13-16,19H2,1-4H3