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

Systemtic Name: 4-[3-[(4-methylphenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanylbutanenitrile Openeye Name: 4-[4-oxo-3-(p-tolylmethyl)quinazolin-2-yl]sulfanylbutanenitrile CAS Name: 4-[[3-[(4-methylphenyl)methyl]-4-oxo-2-quinazolinyl]thio]butanenitrile IUPAC Name: 4-[3-[(4-methylphenyl)methyl]-4-oxoquinazolin-2-yl]sulfanylbutanenitrile Traditional Name: 4-[[4-keto-3-(4-methylbenzyl)quinazolin-2-yl]thio]butyronitrile Formula: C20H19N3OS MolecularWeight: 349.44936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCCCC#N

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCCCC#N

InChI

InChI=1S/C20H19N3OS/c1-15-8-10-16(11-9-15)14-23-19(24)17-6-2-3-7-18(17)22-20(23)25-13-5-4-12-21/h2-3,6-11H,4-5,13-14H2,1H3