N-[2-[3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanoylamino]ethyl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[2-[3-(6-methyl-2-methylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanoylamino]ethyl]-4-(trifluoromethyl)benzamide Openeye Name: N-[2-[3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanoylamino]ethyl]-4-(trifluoromethyl)benzamide CAS Name: N-[2-[[3-[6-methyl-2-(methylthio)-4-oxo-1H-pyrimidin-5-yl]-1-oxopropyl]amino]ethyl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[2-[3-(6-methyl-2-methylsulfanyl-4-oxo-1H-pyrimidin-5-yl)propanoylamino]ethyl]-4-(trifluoromethyl)benzamide Traditional Name: N-[2-[3-[4-keto-6-methyl-2-(methylthio)-1H-pyrimidin-5-yl]propanoylamino]ethyl]-4-(trifluoromethyl)benzamide Formula: C19H21F3N4O3S MolecularWeight: 442.45525

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SC)CCC(=O)NCCNC(=O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SC)CCC(=O)NCCNC(=O)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C19H21F3N4O3S/c1-11-14(17(29)26-18(25-11)30-2)7-8-15(27)23-9-10-24-16(28)12-3-5-13(6-4-12)19(20,21)22/h3-6H,7-10H2,1-2H3,(H,23,27)(H,24,28)(H,25,26,29)