N-(furan-2-ylmethyl)-4-[2-[(3-nitrophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]butanamide

Systemtic Name: N-(furan-2-ylmethyl)-4-[2-[(3-nitrophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]butanamide Openeye Name: N-(2-furylmethyl)-4-[2-[(3-nitrophenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]butanamide CAS Name: N-(2-furanylmethyl)-4-[2-[(3-nitrophenyl)methylthio]-4-oxo-3-quinazolinyl]butanamide IUPAC Name: N-(furan-2-ylmethyl)-4-[2-[(3-nitrophenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]butanamide Traditional Name: N-(2-furfuryl)-4-[4-keto-2-[(3-nitrobenzyl)thio]quinazolin-3-yl]butyramide Formula: C24H22N4O5S MolecularWeight: 478.52028

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CC(=CC=C3)[N+](=O)[O-])CCCC(=O)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CC(=CC=C3)[N+](=O)[O-])CCCC(=O)NCC4=CC=CO4

InChI

InChI=1S/C24H22N4O5S/c29-22(25-15-19-8-5-13-33-19)11-4-12-27-23(30)20-9-1-2-10-21(20)26-24(27)34-16-17-6-3-7-18(14-17)28(31)32/h1-3,5-10,13-14H,4,11-12,15-16H2,(H,25,29)