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

Systemtic Name: (2R)-3-[3-(2-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-2-methyl-propanenitrile Openeye Name: (2R)-3-[3-(2-ethoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-2-methyl-propanenitrile CAS Name: (2R)-3-[[3-(2-ethoxyphenyl)-4-oxo-2-quinazolinyl]thio]-2-methylpropanenitrile IUPAC Name: (2R)-3-[3-(2-ethoxyphenyl)-4-oxoquinazolin-2-yl]sulfanyl-2-methylpropanenitrile Traditional Name: (2R)-3-[(4-keto-3-o-phenetyl-quinazolin-2-yl)thio]-2-methyl-propionitrile Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC(C)C#N

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SC[C@H](C)C#N

InChI

InChI=1S/C20H19N3O2S/c1-3-25-18-11-7-6-10-17(18)23-19(24)15-8-4-5-9-16(15)22-20(23)26-13-14(2)12-21/h4-11,14H,3,13H2,1-2H3/t14-/m1/s1