2-[[6-[(2,5-dimethylphenyl)methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl]-N-(3-fluoranyl-4-methyl-phenyl)ethanamide

Systemtic Name: 2-[[6-[(2,5-dimethylphenyl)methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl]-N-(3-fluoranyl-4-methyl-phenyl)ethanamide Openeye Name: 2-[[6-[(2,5-dimethylphenyl)methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl]-N-(3-fluoro-4-methyl-phenyl)acetamide CAS Name: 2-[[6-[(2,5-dimethylphenyl)methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]thio]-N-(3-fluoro-4-methylphenyl)acetamide IUPAC Name: 2-[[6-[(2,5-dimethylphenyl)methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide Traditional Name: 2-[[6-(2,5-dimethylbenzyl)-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]thio]-N-(3-fluoro-4-methyl-phenyl)acetamide Formula: C25H26FN5OS MolecularWeight: 463.570243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CC2=C(N3C(=NC(=N3)SCC(=O)NC4=CC(=C(C=C4)C)F)N=C2C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CC2=C(N3C(=NC(=N3)SCC(=O)NC4=CC(=C(C=C4)C)F)N=C2C)C

InChI

InChI=1S/C25H26FN5OS/c1-14-6-7-15(2)19(10-14)11-21-17(4)27-24-29-25(30-31(24)18(21)5)33-13-23(32)28-20-9-8-16(3)22(26)12-20/h6-10,12H,11,13H2,1-5H3,(H,28,32)