2-(5-chloranyl-6-propan-2-yl-pyrimidin-4-yl)sulfanyl-N-(2-cyano-3-methyl-butan-2-yl)propanamide

Systemtic Name: 2-(5-chloranyl-6-propan-2-yl-pyrimidin-4-yl)sulfanyl-N-(2-cyano-3-methyl-butan-2-yl)propanamide Openeye Name: 2-(5-chloro-6-isopropyl-pyrimidin-4-yl)sulfanyl-N-(1-cyano-1,2-dimethyl-propyl)propanamide CAS Name: 2-[(5-chloro-6-propan-2-yl-4-pyrimidinyl)thio]-N-(2-cyano-3-methylbutan-2-yl)propanamide IUPAC Name: 2-(5-chloro-6-propan-2-ylpyrimidin-4-yl)sulfanyl-N-(2-cyano-3-methylbutan-2-yl)propanamide Traditional Name: 2-[(5-chloro-6-isopropyl-pyrimidin-4-yl)thio]-N-(1-cyano-1,2-dimethyl-propyl)propionamide Formula: C16H23ClN4OS MolecularWeight: 354.89802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NC=N1)SC(C)C(=O)NC(C)(C#N)C(C)C)Cl

Isomeric SMILES

CC(C)C1=C(C(=NC=N1)SC(C)C(=O)NC(C)(C#N)C(C)C)Cl

InChI

InChI=1S/C16H23ClN4OS/c1-9(2)13-12(17)15(20-8-19-13)23-11(5)14(22)21-16(6,7-18)10(3)4/h8-11H,1-6H3,(H,21,22)