2-ethyl-4-methyl-6-[2-oxidanylidene-2-[3-oxidanylidene-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]ethyl]sulfanyl-pyrimidine-5-carbonitrile

Systemtic Name: 2-ethyl-4-methyl-6-[2-oxidanylidene-2-[3-oxidanylidene-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]ethyl]sulfanyl-pyrimidine-5-carbonitrile Openeye Name: 2-ethyl-4-methyl-6-[2-oxo-2-[3-oxo-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]ethyl]sulfanyl-pyrimidine-5-carbonitrile CAS Name: 2-ethyl-4-methyl-6-[[2-oxo-2-[3-oxo-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]ethyl]thio]-5-pyrimidinecarbonitrile IUPAC Name: 2-ethyl-4-methyl-6-[2-oxo-2-[3-oxo-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]ethyl]sulfanylpyrimidine-5-carbonitrile Traditional Name: 2-ethyl-4-[[2-keto-2-[3-keto-6-(trifluoromethyl)-2,4-dihydroquinoxalin-1-yl]ethyl]thio]-6-methyl-pyrimidine-5-carbonitrile Formula: C19H16F3N5O2S MolecularWeight: 435.42285

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(C(=N1)SCC(=O)N2CC(=O)NC3=C2C=CC(=C3)C(F)(F)F)C#N)C

Isomeric SMILES

CCC1=NC(=C(C(=N1)SCC(=O)N2CC(=O)NC3=C2C=CC(=C3)C(F)(F)F)C#N)C

InChI

InChI=1S/C19H16F3N5O2S/c1-3-15-24-10(2)12(7-23)18(26-15)30-9-17(29)27-8-16(28)25-13-6-11(19(20,21)22)4-5-14(13)27/h4-6H,3,8-9H2,1-2H3,(H,25,28)