4-[[4-[3-(6-nitro-4-oxidanylidene-1-phenyl-2H-quinazolin-3-yl)propoxy]phenyl]methyl]-1,3-thiazolidine-2,5-dione

Systemtic Name: 4-[[4-[3-(6-nitro-4-oxidanylidene-1-phenyl-2H-quinazolin-3-yl)propoxy]phenyl]methyl]-1,3-thiazolidine-2,5-dione Openeye Name: 4-[[4-[3-(6-nitro-4-oxo-1-phenyl-2H-quinazolin-3-yl)propoxy]phenyl]methyl]thiazolidine-2,5-dione CAS Name: 4-[[4-[3-(6-nitro-4-oxo-1-phenyl-2H-quinazolin-3-yl)propoxy]phenyl]methyl]thiazolidine-2,5-dione IUPAC Name: 4-[[4-[3-(6-nitro-4-oxo-1-phenyl-2H-quinazolin-3-yl)propoxy]phenyl]methyl]-1,3-thiazolidine-2,5-dione Traditional Name: 4-[4-[3-(4-keto-6-nitro-1-phenyl-2H-quinazolin-3-yl)propoxy]benzyl]thiazolidine-2,5-quinone Formula: C27H24N4O6S MolecularWeight: 532.56766

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Descriptors Computed from Structure

Canonical SMILES:

C1N(C(=O)C2=C(N1C3=CC=CC=C3)C=CC(=C2)[N+](=O)[O-])CCCOC4=CC=C(C=C4)CC5C(=O)SC(=O)N5

Isomeric SMILES

C1N(C(=O)C2=C(N1C3=CC=CC=C3)C=CC(=C2)[N+](=O)[O-])CCCOC4=CC=C(C=C4)CC5C(=O)SC(=O)N5

InChI

InChI=1S/C27H24N4O6S/c32-25-22-16-20(31(35)36)9-12-24(22)30(19-5-2-1-3-6-19)17-29(25)13-4-14-37-21-10-7-18(8-11-21)15-23-26(33)38-27(34)28-23/h1-3,5-12,16,23H,4,13-15,17H2,(H,28,34)