1-[[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]methyl]-1,2,4-triazole-3-carbonitrile

Systemtic Name: 1-[[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]methyl]-1,2,4-triazole-3-carbonitrile Openeye Name: 1-[[3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]methyl]-1,2,4-triazole-3-carbonitrile CAS Name: 1-[[3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]methyl]-1,2,4-triazole-3-carbonitrile IUPAC Name: 1-[[3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]methyl]-1,2,4-triazole-3-carbonitrile Traditional Name: 1-[[3-(2-furfuryl)-4-keto-quinazolin-2-yl]methyl]-1,2,4-triazole-3-carbonitrile Formula: C17H12N6O2 MolecularWeight: 332.31618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)CN3C=NC(=N3)C#N)CC4=CC=CO4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)CN3C=NC(=N3)C#N)CC4=CC=CO4

InChI

InChI=1S/C17H12N6O2/c18-8-15-19-11-22(21-15)10-16-20-14-6-2-1-5-13(14)17(24)23(16)9-12-4-3-7-25-12/h1-7,11H,9-10H2