(2R)-2-methyl-3-[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanenitrile

Systemtic Name: (2R)-2-methyl-3-[3-(2-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanenitrile Openeye Name: (2R)-2-methyl-3-[3-(o-tolyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanenitrile CAS Name: (2R)-2-methyl-3-[[3-(2-methylphenyl)-4-oxo-2-quinazolinyl]thio]propanenitrile IUPAC Name: (2R)-2-methyl-3-[3-(2-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanenitrile Traditional Name: (2R)-3-[[4-keto-3-(o-tolyl)quinazolin-2-yl]thio]-2-methyl-propionitrile Formula: C19H17N3OS MolecularWeight: 335.42278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(C)C#N

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SC[C@H](C)C#N

InChI

InChI=1S/C19H17N3OS/c1-13(11-20)12-24-19-21-16-9-5-4-8-15(16)18(23)22(19)17-10-6-3-7-14(17)2/h3-10,13H,12H2,1-2H3/t13-/m1/s1