2-methyl-4-oxidanylidene-3-[4-[[4-oxidanylidene-2-(3-phenoxyphenyl)-1,3-thiazolidin-3-yl]carbamoyl]phenyl]quinazoline-6-sulfonic acid

Systemtic Name: 2-methyl-4-oxidanylidene-3-[4-[[4-oxidanylidene-2-(3-phenoxyphenyl)-1,3-thiazolidin-3-yl]carbamoyl]phenyl]quinazoline-6-sulfonic acid Openeye Name: 2-methyl-4-oxo-3-[4-[[4-oxo-2-(3-phenoxyphenyl)thiazolidin-3-yl]carbamoyl]phenyl]quinazoline-6-sulfonic acid CAS Name: 2-methyl-4-oxo-3-[4-[oxo-[[4-oxo-2-(3-phenoxyphenyl)-3-thiazolidinyl]amino]methyl]phenyl]-6-quinazolinesulfonic acid IUPAC Name: 2-methyl-4-oxo-3-[4-[[4-oxo-2-(3-phenoxyphenyl)-1,3-thiazolidin-3-yl]carbamoyl]phenyl]quinazoline-6-sulfonic acid Traditional Name: 4-keto-3-[4-[[4-keto-2-(3-phenoxyphenyl)thiazolidin-3-yl]carbamoyl]phenyl]-2-methyl-quinazoline-6-sulfonic acid Formula: C31H24N4O7S2 MolecularWeight: 628.67486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)S(=O)(=O)O)C(=O)N1C3=CC=C(C=C3)C(=O)NN4C(SCC4=O)C5=CC(=CC=C5)OC6=CC=CC=C6

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)S(=O)(=O)O)C(=O)N1C3=CC=C(C=C3)C(=O)NN4C(SCC4=O)C5=CC(=CC=C5)OC6=CC=CC=C6

InChI

InChI=1S/C31H24N4O7S2/c1-19-32-27-15-14-25(44(39,40)41)17-26(27)30(38)34(19)22-12-10-20(11-13-22)29(37)33-35-28(36)18-43-31(35)21-6-5-9-24(16-21)42-23-7-3-2-4-8-23/h2-17,31H,18H2,1H3,(H,33,37)(H,39,40,41)