N-(furan-2-ylmethyl)-4-(4-oxidanylidene-2-phenacylsulfanyl-quinazolin-3-yl)butanamide

Systemtic Name: N-(furan-2-ylmethyl)-4-(4-oxidanylidene-2-phenacylsulfanyl-quinazolin-3-yl)butanamide Openeye Name: N-(2-furylmethyl)-4-(4-oxo-2-phenacylsulfanyl-quinazolin-3-yl)butanamide CAS Name: N-(2-furanylmethyl)-4-[4-oxo-2-(phenacylthio)-3-quinazolinyl]butanamide IUPAC Name: N-(furan-2-ylmethyl)-4-(4-oxo-2-phenacylsulfanylquinazolin-3-yl)butanamide Traditional Name: N-(2-furfuryl)-4-[4-keto-2-(phenacylthio)quinazolin-3-yl]butyramide Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCC(=O)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCC(=O)NCC4=CC=CO4

InChI

InChI=1S/C25H23N3O4S/c29-22(18-8-2-1-3-9-18)17-33-25-27-21-12-5-4-11-20(21)24(31)28(25)14-6-13-23(30)26-16-19-10-7-15-32-19/h1-5,7-12,15H,6,13-14,16-17H2,(H,26,30)