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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)SC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3

Isomeric SMILES

C[C@H](C#N)SC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3

InChI

InChI=1S/C18H15N3OS/c1-13(11-19)23-18-20-16-10-6-5-9-15(16)17(22)21(18)12-14-7-3-2-4-8-14/h2-10,13H,12H2,1H3/t13-/m1/s1