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

Systemtic Name: 2-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanenitrile Openeye Name: 2-[4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanylpropanenitrile CAS Name: 2-[[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]propanenitrile IUPAC Name: 2-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanenitrile Traditional Name: 2-[[4-keto-3-(p-tolyl)quinazolin-2-yl]thio]propionitrile Formula: C18H15N3OS MolecularWeight: 321.3962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SC(C)C#N

InChI

InChI=1S/C18H15N3OS/c1-12-7-9-14(10-8-12)21-17(22)15-5-3-4-6-16(15)20-18(21)23-13(2)11-19/h3-10,13H,1-2H3