dimethyl 3-methyl-5-[[[4-oxidanylidene-3-(phenylmethyl)phthalazin-1-yl]carbonylamino]sulfamoyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-[[[4-oxidanylidene-3-(phenylmethyl)phthalazin-1-yl]carbonylamino]sulfamoyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[[(3-benzyl-4-oxo-phthalazine-1-carbonyl)amino]sulfamoyl]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[[oxo-[4-oxo-3-(phenylmethyl)-1-phthalazinyl]methyl]amino]sulfamoyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[(3-benzyl-4-oxophthalazine-1-carbonyl)amino]sulfamoyl]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[(3-benzyl-4-keto-phthalazine-1-carbonyl)amino]sulfamoyl]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C25H22N4O8S2 MolecularWeight: 570.59418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)S(=O)(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)S(=O)(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C25H22N4O8S2/c1-14-18(23(32)36-2)25(38-20(14)24(33)37-3)39(34,35)28-26-21(30)19-16-11-7-8-12-17(16)22(31)29(27-19)13-15-9-5-4-6-10-15/h4-12,28H,13H2,1-3H3,(H,26,30)