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

Systemtic Name: 2-[3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanenitrile Openeye Name: 2-[3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanylacetonitrile CAS Name: 2-[[3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]acetonitrile IUPAC Name: 2-[3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanylacetonitrile Traditional Name: 2-[[4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]acetonitrile Formula: C13H13N3O2S MolecularWeight: 275.32622

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=CC=CC=C2N=C1SCC#N

Isomeric SMILES

COCCN1C(=O)C2=CC=CC=C2N=C1SCC#N

InChI

InChI=1S/C13H13N3O2S/c1-18-8-7-16-12(17)10-4-2-3-5-11(10)15-13(16)19-9-6-14/h2-5H,7-9H2,1H3