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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCCC#N

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCCC#N

InChI

InChI=1S/C19H17N3O2S/c1-24-15-9-7-14(8-10-15)13-22-18(23)16-5-2-3-6-17(16)21-19(22)25-12-4-11-20/h2-3,5-10H,4,12-13H2,1H3