3-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanenitrile

Systemtic Name: 3-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanenitrile Openeye Name: 3-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanylpropanenitrile CAS Name: 3-[[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]thio]propanenitrile IUPAC Name: 3-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanenitrile Traditional Name: 3-[(4-keto-3-p-phenetyl-quinazolin-2-yl)thio]propionitrile Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCC#N

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCC#N

InChI

InChI=1S/C19H17N3O2S/c1-2-24-15-10-8-14(9-11-15)22-18(23)16-6-3-4-7-17(16)21-19(22)25-13-5-12-20/h3-4,6-11H,2,5,13H2,1H3