N-[4-[3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanoylamino]phenyl]furan-2-carboxamide

Systemtic Name: N-[4-[3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanoylamino]phenyl]furan-2-carboxamide Openeye Name: N-[4-[3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanoylamino]phenyl]furan-2-carboxamide CAS Name: N-[4-[[1-oxo-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propyl]amino]phenyl]-2-furancarboxamide IUPAC Name: N-[4-[3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanoylamino]phenyl]furan-2-carboxamide Traditional Name: N-[4-[3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propanoylamino]phenyl]-2-furamide Formula: C22H18N4O4S MolecularWeight: 434.46772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCC(=O)NC3=CC=C(C=C3)NC(=O)C4=CC=CO4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCC(=O)NC3=CC=C(C=C3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C22H18N4O4S/c27-19(11-12-26-21(29)16-4-1-2-5-17(16)25-22(26)31)23-14-7-9-15(10-8-14)24-20(28)18-6-3-13-30-18/h1-10,13H,11-12H2,(H,23,27)(H,24,28)(H,25,31)