2-[4-oxidanylidene-3-(1-phenylethyl)quinazolin-2-yl]sulfanylethanenitrile

Systemtic Name: 2-[4-oxidanylidene-3-(1-phenylethyl)quinazolin-2-yl]sulfanylethanenitrile Openeye Name: 2-[4-oxo-3-(1-phenylethyl)quinazolin-2-yl]sulfanylacetonitrile CAS Name: 2-[[4-oxo-3-(1-phenylethyl)-2-quinazolinyl]thio]acetonitrile IUPAC Name: 2-[4-oxo-3-(1-phenylethyl)quinazolin-2-yl]sulfanylacetonitrile Traditional Name: 2-[[4-keto-3-(1-phenylethyl)quinazolin-2-yl]thio]acetonitrile Formula: C18H15N3OS MolecularWeight: 321.3962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC#N

Isomeric SMILES

CC(C1=CC=CC=C1)N2C(=O)C3=CC=CC=C3N=C2SCC#N

InChI

InChI=1S/C18H15N3OS/c1-13(14-7-3-2-4-8-14)21-17(22)15-9-5-6-10-16(15)20-18(21)23-12-11-19/h2-10,13H,12H2,1H3