(2S)-2-(5-cyano-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-N-cyclopropyl-2-phenyl-ethanamide

Systemtic Name: (2S)-2-(5-cyano-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-N-cyclopropyl-2-phenyl-ethanamide Openeye Name: (2S)-2-(5-cyano-2,6-dimethyl-pyrimidin-4-yl)sulfanyl-N-cyclopropyl-2-phenyl-acetamide CAS Name: (2S)-2-[(5-cyano-2,6-dimethyl-4-pyrimidinyl)thio]-N-cyclopropyl-2-phenylacetamide IUPAC Name: (2S)-2-(5-cyano-2,6-dimethylpyrimidin-4-yl)sulfanyl-N-cyclopropyl-2-phenylacetamide Traditional Name: (2S)-2-[(5-cyano-2,6-dimethyl-pyrimidin-4-yl)thio]-N-cyclopropyl-2-phenyl-acetamide Formula: C18H18N4OS MolecularWeight: 338.42672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)SC(C2=CC=CC=C2)C(=O)NC3CC3)C#N

Isomeric SMILES

CC1=C(C(=NC(=N1)C)S[C@@H](C2=CC=CC=C2)C(=O)NC3CC3)C#N

InChI

InChI=1S/C18H18N4OS/c1-11-15(10-19)18(21-12(2)20-11)24-16(13-6-4-3-5-7-13)17(23)22-14-8-9-14/h3-7,14,16H,8-9H2,1-2H3,(H,22,23)/t16-/m0/s1