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

Systemtic Name: 4-[2-(cyanomethylsulfanyl)-4-oxidanylidene-quinazolin-3-yl]-N-(furan-2-ylmethyl)butanamide Openeye Name: 4-[2-(cyanomethylsulfanyl)-4-oxo-quinazolin-3-yl]-N-(2-furylmethyl)butanamide CAS Name: 4-[2-(cyanomethylthio)-4-oxo-3-quinazolinyl]-N-(2-furanylmethyl)butanamide IUPAC Name: 4-[2-(cyanomethylsulfanyl)-4-oxoquinazolin-3-yl]-N-(furan-2-ylmethyl)butanamide Traditional Name: 4-[2-(cyanomethylthio)-4-keto-quinazolin-3-yl]-N-(2-furfuryl)butyramide Formula: C19H18N4O3S MolecularWeight: 382.43622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC#N)CCCC(=O)NCC3=CC=CO3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC#N)CCCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C19H18N4O3S/c20-9-12-27-19-22-16-7-2-1-6-15(16)18(25)23(19)10-3-8-17(24)21-13-14-5-4-11-26-14/h1-2,4-7,11H,3,8,10,12-13H2,(H,21,24)