2-[4-chloranyl-6-(diethylamino)pyrimidin-2-yl]sulfanyl-N-[[3-(trifluoromethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-[4-chloranyl-6-(diethylamino)pyrimidin-2-yl]sulfanyl-N-[[3-(trifluoromethyl)phenyl]methyl]ethanamide Openeye Name: 2-[4-chloro-6-(diethylamino)pyrimidin-2-yl]sulfanyl-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide CAS Name: 2-[[4-chloro-6-(diethylamino)-2-pyrimidinyl]thio]-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide IUPAC Name: 2-[4-chloro-6-(diethylamino)pyrimidin-2-yl]sulfanyl-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide Traditional Name: 2-[[4-chloro-6-(diethylamino)pyrimidin-2-yl]thio]-N-[3-(trifluoromethyl)benzyl]acetamide Formula: C18H20ClF3N4OS MolecularWeight: 432.89081

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=NC(=N1)SCC(=O)NCC2=CC(=CC=C2)C(F)(F)F)Cl

Isomeric SMILES

CCN(CC)C1=CC(=NC(=N1)SCC(=O)NCC2=CC(=CC=C2)C(F)(F)F)Cl

InChI

InChI=1S/C18H20ClF3N4OS/c1-3-26(4-2)15-9-14(19)24-17(25-15)28-11-16(27)23-10-12-6-5-7-13(8-12)18(20,21)22/h5-9H,3-4,10-11H2,1-2H3,(H,23,27)