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

Systemtic Name: N-[6-azanyl-2-(2-ethoxyethylsulfanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide Openeye Name: N-[6-amino-2-(2-ethoxyethylsulfanyl)-4-oxo-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide CAS Name: N-[6-amino-2-(2-ethoxyethylthio)-4-oxo-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[6-amino-2-(2-ethoxyethylsulfanyl)-4-oxo-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide Traditional Name: N-[6-amino-2-(2-ethoxyethylthio)-4-keto-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide Formula: C16H17F3N4O3S MolecularWeight: 402.39139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCOCCSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C16H17F3N4O3S/c1-2-26-7-8-27-15-22-12(20)11(14(25)23-15)21-13(24)9-3-5-10(6-4-9)16(17,18)19/h3-6H,2,7-8H2,1H3,(H,21,24)(H3,20,22,23,25)