(2S)-2-methyl-3-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-propanenitrile

Systemtic Name: (2S)-2-methyl-3-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-propanenitrile Openeye Name: (2S)-3-(3-benzyl-4-oxo-quinazolin-2-yl)sulfanyl-2-methyl-propanenitrile CAS Name: (2S)-2-methyl-3-[[4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]propanenitrile IUPAC Name: (2S)-3-(3-benzyl-4-oxoquinazolin-2-yl)sulfanyl-2-methylpropanenitrile Traditional Name: (2S)-3-[(3-benzyl-4-keto-quinazolin-2-yl)thio]-2-methyl-propionitrile Formula: C19H17N3OS MolecularWeight: 335.42278

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3)C#N

Isomeric SMILES

C[C@H](CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3)C#N

InChI

InChI=1S/C19H17N3OS/c1-14(11-20)13-24-19-21-17-10-6-5-9-16(17)18(23)22(19)12-15-7-3-2-4-8-15/h2-10,14H,12-13H2,1H3/t14-/m0/s1