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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SC(C)C#N

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2S[C@H](C)C#N

InChI

InChI=1S/C18H15N3OS/c1-12-7-3-6-10-16(12)21-17(22)14-8-4-5-9-15(14)20-18(21)23-13(2)11-19/h3-10,13H,1-2H3/t13-/m1/s1