2-[2,4-bis(oxidanylidene)-3-(phenylmethyl)quinazolin-1-yl]ethanenitrile

Systemtic Name: 2-[2,4-bis(oxidanylidene)-3-(phenylmethyl)quinazolin-1-yl]ethanenitrile Openeye Name: 2-(3-benzyl-2,4-dioxo-quinazolin-1-yl)acetonitrile CAS Name: 2-[2,4-dioxo-3-(phenylmethyl)-1-quinazolinyl]acetonitrile IUPAC Name: 2-(3-benzyl-2,4-dioxoquinazolin-1-yl)acetonitrile Traditional Name: 2-(3-benzyl-2,4-diketo-quinazolin-1-yl)acetonitrile Formula: C17H13N3O2 MolecularWeight: 291.30402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N(C2=O)CC#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N(C2=O)CC#N

InChI

InChI=1S/C17H13N3O2/c18-10-11-19-15-9-5-4-8-14(15)16(21)20(17(19)22)12-13-6-2-1-3-7-13/h1-9H,11-12H2