N-[2,4-bis(fluoranyl)phenyl]-2-[[5-[[2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]methyl]-4-(2,5-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-[2,4-bis(fluoranyl)phenyl]-2-[[5-[[2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]methyl]-4-(2,5-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2,4-difluorophenyl)-2-[[4-(2,5-dimethylphenyl)-5-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2,4-difluorophenyl)-2-[[4-(2,5-dimethylphenyl)-5-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2,4-difluorophenyl)-2-[[4-(2,5-dimethylphenyl)-5-[(2,4-dioxo-1H-pyrimidin-6-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2,4-difluorophenyl)-2-[[5-[(2,4-diketo-1H-pyrimidin-6-yl)methyl]-4-(2,5-dimethylphenyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C23H20F2N6O3S MolecularWeight: 498.505106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=NN=C2SCC(=O)NC3=C(C=C(C=C3)F)F)CC4=CC(=O)NC(=O)N4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=NN=C2SCC(=O)NC3=C(C=C(C=C3)F)F)CC4=CC(=O)NC(=O)N4

InChI

InChI=1S/C23H20F2N6O3S/c1-12-3-4-13(2)18(7-12)31-19(9-15-10-20(32)28-22(34)26-15)29-30-23(31)35-11-21(33)27-17-6-5-14(24)8-16(17)25/h3-8,10H,9,11H2,1-2H3,(H,27,33)(H2,26,28,32,34)