2-(4-phenylazanylquinazolin-2-yl)sulfanylethanenitrile

Systemtic Name: 2-(4-phenylazanylquinazolin-2-yl)sulfanylethanenitrile Openeye Name: 2-(4-anilinoquinazolin-2-yl)sulfanylacetonitrile CAS Name: 2-[(4-anilino-2-quinazolinyl)thio]acetonitrile IUPAC Name: 2-(4-anilinoquinazolin-2-yl)sulfanylacetonitrile Traditional Name: 2-[(4-anilinoquinazolin-2-yl)thio]acetonitrile Formula: C16H12N4S MolecularWeight: 292.35828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C32)SCC#N

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C32)SCC#N

InChI

InChI=1S/C16H12N4S/c17-10-11-21-16-19-14-9-5-4-8-13(14)15(20-16)18-12-6-2-1-3-7-12/h1-9H,11H2,(H,18,19,20)