2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(1-phenylethyl)butanamide

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(1-phenylethyl)butanamide Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(1-phenylethyl)butanamide CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-(1-phenylethyl)butanamide IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(1-phenylethyl)butanamide Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-(1-phenylethyl)butyramide Formula: C18H23N3OS MolecularWeight: 329.45972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(C)C1=CC=CC=C1)SC2=NC(=CC(=N2)C)C

Isomeric SMILES

CCC(C(=O)NC(C)C1=CC=CC=C1)SC2=NC(=CC(=N2)C)C

InChI

InChI=1S/C18H23N3OS/c1-5-16(23-18-19-12(2)11-13(3)20-18)17(22)21-14(4)15-9-7-6-8-10-15/h6-11,14,16H,5H2,1-4H3,(H,21,22)