N-[6-azanyl-2-[(4-methylphenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[6-azanyl-2-[(4-methylphenyl)methylsulfanyl]-4-oxidanylidene-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide Openeye Name: N-[6-amino-4-oxo-2-(p-tolylmethylsulfanyl)-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide CAS Name: N-[6-amino-2-[(4-methylphenyl)methylthio]-4-oxo-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[6-amino-2-[(4-methylphenyl)methylsulfanyl]-4-oxo-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide Traditional Name: N-[6-amino-4-keto-2-[(4-methylbenzyl)thio]-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide Formula: C20H17F3N4O2S MolecularWeight: 434.43479

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC(=O)C(=C(N2)N)NC(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC(=O)C(=C(N2)N)NC(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H17F3N4O2S/c1-11-2-4-12(5-3-11)10-30-19-26-16(24)15(18(29)27-19)25-17(28)13-6-8-14(9-7-13)20(21,22)23/h2-9H,10H2,1H3,(H,25,28)(H3,24,26,27,29)