(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl (E)-3-[4-(furan-2-ylmethylsulfamoyl)phenyl]prop-2-enoate

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl (E)-3-[4-(furan-2-ylmethylsulfamoyl)phenyl]prop-2-enoate Openeye Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl (E)-3-[4-(2-furylmethylsulfamoyl)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(2-furanylmethylsulfamoyl)phenyl]-2-propenoic acid (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl (E)-3-[4-(furan-2-ylmethylsulfamoyl)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(2-furfurylsulfamoyl)phenyl]acrylic acid (7-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C23H18ClN3O6S MolecularWeight: 499.92352

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNS(=O)(=O)C2=CC=C(C=C2)C=CC(=O)OCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

C1=COC(=C1)CNS(=O)(=O)C2=CC=C(C=C2)/C=C/C(=O)OCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C23H18ClN3O6S/c24-16-6-9-19-20(12-16)26-21(27-23(19)29)14-33-22(28)10-5-15-3-7-18(8-4-15)34(30,31)25-13-17-2-1-11-32-17/h1-12,25H,13-14H2,(H,26,27,29)/b10-5+