N-cyclopropyl-2-[4-oxidanylidene-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-1H-pyrimidin-6-yl]ethanamide

Systemtic Name: N-cyclopropyl-2-[4-oxidanylidene-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-1H-pyrimidin-6-yl]ethanamide Openeye Name: N-cyclopropyl-2-[4-oxo-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-1H-pyrimidin-6-yl]acetamide CAS Name: N-cyclopropyl-2-[4-oxo-2-[[4-(trifluoromethyl)phenyl]methylthio]-1H-pyrimidin-6-yl]acetamide IUPAC Name: N-cyclopropyl-2-[4-oxo-2-[[4-(trifluoromethyl)phenyl]methylsulfanyl]-1H-pyrimidin-6-yl]acetamide Traditional Name: N-cyclopropyl-2-[4-keto-2-[[4-(trifluoromethyl)benzyl]thio]-1H-pyrimidin-6-yl]acetamide Formula: C17H16F3N3O2S MolecularWeight: 383.38805

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CC2=CC(=O)N=C(N2)SCC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CC1NC(=O)CC2=CC(=O)N=C(N2)SCC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H16F3N3O2S/c18-17(19,20)11-3-1-10(2-4-11)9-26-16-22-13(8-15(25)23-16)7-14(24)21-12-5-6-12/h1-4,8,12H,5-7,9H2,(H,21,24)(H,22,23,25)