N-(3-chloranyl-4-fluoranyl-phenyl)-4-methyl-6-methylsulfanyl-2-propan-2-yl-pyrimidine-5-carboxamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-4-methyl-6-methylsulfanyl-2-propan-2-yl-pyrimidine-5-carboxamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-2-isopropyl-4-methyl-6-methylsulfanyl-pyrimidine-5-carboxamide CAS Name: N-(3-chloro-4-fluorophenyl)-4-methyl-6-(methylthio)-2-propan-2-yl-5-pyrimidinecarboxamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-4-methyl-6-methylsulfanyl-2-propan-2-ylpyrimidine-5-carboxamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-2-isopropyl-4-methyl-6-(methylthio)pyrimidine-5-carboxamide Formula: C16H17ClFN3OS MolecularWeight: 353.842083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C(C)C)SC)C(=O)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CC1=C(C(=NC(=N1)C(C)C)SC)C(=O)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C16H17ClFN3OS/c1-8(2)14-19-9(3)13(16(21-14)23-4)15(22)20-10-5-6-12(18)11(17)7-10/h5-8H,1-4H3,(H,20,22)