(2R)-2-ethanimidoyl-4-(2-methylquinazolin-4-yl)sulfanyl-3-oxidanylidene-butanenitrile

Systemtic Name: (2R)-2-ethanimidoyl-4-(2-methylquinazolin-4-yl)sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: (2R)-2-ethanimidoyl-4-(2-methylquinazolin-4-yl)sulfanyl-3-oxo-butanenitrile CAS Name: (2R)-2-(1-iminoethyl)-4-[(2-methyl-4-quinazolinyl)thio]-3-oxobutanenitrile IUPAC Name: (2R)-2-ethanimidoyl-4-(2-methylquinazolin-4-yl)sulfanyl-3-oxobutanenitrile Traditional Name: (2R)-2-acetimidoyl-3-keto-4-[(2-methylquinazolin-4-yl)thio]butyronitrile Formula: C15H14N4OS MolecularWeight: 298.36286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)C(C#N)C(=N)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)[C@@H](C#N)C(=N)C

InChI

InChI=1S/C15H14N4OS/c1-9(17)12(7-16)14(20)8-21-15-11-5-3-4-6-13(11)18-10(2)19-15/h3-6,12,17H,8H2,1-2H3/t12-/m0/s1