4-oxidanylidene-3-pentyl-quinazoline-2-carbonitrile

Systemtic Name: 4-oxidanylidene-3-pentyl-quinazoline-2-carbonitrile Openeye Name: 4-oxo-3-pentyl-quinazoline-2-carbonitrile CAS Name: 4-oxo-3-pentyl-2-quinazolinecarbonitrile IUPAC Name: 4-oxo-3-pentylquinazoline-2-carbonitrile Traditional Name: 3-amyl-4-keto-quinazoline-2-carbonitrile Formula: C14H15N3O MolecularWeight: 241.2884

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=NC2=CC=CC=C2C1=O)C#N

Isomeric SMILES

CCCCCN1C(=NC2=CC=CC=C2C1=O)C#N

InChI

InChI=1S/C14H15N3O/c1-2-3-6-9-17-13(10-15)16-12-8-5-4-7-11(12)14(17)18/h4-5,7-8H,2-3,6,9H2,1H3