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

Systemtic Name: 4-[3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylbutanenitrile Openeye Name: 4-[3-[(4-methoxyphenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanylbutanenitrile CAS Name: 4-[[3-[(4-methoxyphenyl)methyl]-4-oxo-2-quinazolinyl]thio]butanenitrile IUPAC Name: 4-[3-[(4-methoxyphenyl)methyl]-4-oxoquinazolin-2-yl]sulfanylbutanenitrile Traditional Name: 4-[(4-keto-3-p-anisyl-quinazolin-2-yl)thio]butyronitrile Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCCCC#N

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCCCC#N

InChI

InChI=1S/C20H19N3O2S/c1-25-16-10-8-15(9-11-16)14-23-19(24)17-6-2-3-7-18(17)22-20(23)26-13-5-4-12-21/h2-3,6-11H,4-5,13-14H2,1H3