(2R)-4-(4-methylquinolin-2-yl)sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanenitrile

Systemtic Name: (2R)-4-(4-methylquinolin-2-yl)sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-butanenitrile Openeye Name: (2R)-4-[(4-methyl-2-quinolyl)sulfanyl]-2-(4-methylthiazol-2-yl)-3-oxo-butanenitrile CAS Name: (2R)-4-[(4-methyl-2-quinolinyl)thio]-2-(4-methyl-2-thiazolyl)-3-oxobutanenitrile IUPAC Name: (2R)-4-(4-methylquinolin-2-yl)sulfanyl-2-(4-methyl-1,3-thiazol-2-yl)-3-oxobutanenitrile Traditional Name: (2R)-3-keto-4-[(4-methyl-2-quinolyl)thio]-2-(4-methylthiazol-2-yl)butyronitrile Formula: C18H15N3OS2 MolecularWeight: 353.4612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)C(C#N)C3=NC(=CS3)C

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)[C@@H](C#N)C3=NC(=CS3)C

InChI

InChI=1S/C18H15N3OS2/c1-11-7-17(21-15-6-4-3-5-13(11)15)23-10-16(22)14(8-19)18-20-12(2)9-24-18/h3-7,9,14H,10H2,1-2H3/t14-/m1/s1