4-[[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[(3-isobutyl-4-oxo-quinazolin-2-yl)amino]benzonitrile CAS Name: 4-[[3-(2-methylpropyl)-4-oxo-2-quinazolinyl]amino]benzonitrile IUPAC Name: 4-[[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]amino]benzonitrile Traditional Name: 4-[(3-isobutyl-4-keto-quinazolin-2-yl)amino]benzonitrile Formula: C19H18N4O MolecularWeight: 318.37242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2N=C1NC3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2N=C1NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H18N4O/c1-13(2)12-23-18(24)16-5-3-4-6-17(16)22-19(23)21-15-9-7-14(11-20)8-10-15/h3-10,13H,12H2,1-2H3,(H,21,22)