7-(3-hydroxyphenyl)-5-methyl-N-(2-methylphenyl)-2-(phenylmethylsulfanyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide

Systemtic Name: 7-(3-hydroxyphenyl)-5-methyl-N-(2-methylphenyl)-2-(phenylmethylsulfanyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide Openeye Name: 2-benzylsulfanyl-7-(3-hydroxyphenyl)-5-methyl-N-(o-tolyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide CAS Name: 7-(3-hydroxyphenyl)-5-methyl-N-(2-methylphenyl)-2-(phenylmethylthio)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide IUPAC Name: 2-benzylsulfanyl-7-(3-hydroxyphenyl)-5-methyl-N-(2-methylphenyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide Traditional Name: 2-(benzylthio)-7-(3-hydroxyphenyl)-5-methyl-N-(o-tolyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide Formula: C27H25N5O2S MolecularWeight: 483.5847

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=C(N=C3N=C(NN3C2C4=CC(=CC=C4)O)SCC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=C(N=C3N=C(NN3C2C4=CC(=CC=C4)O)SCC5=CC=CC=C5)C

InChI

InChI=1S/C27H25N5O2S/c1-17-9-6-7-14-22(17)29-25(34)23-18(2)28-26-30-27(35-16-19-10-4-3-5-11-19)31-32(26)24(23)20-12-8-13-21(33)15-20/h3-15,24,33H,16H2,1-2H3,(H,29,34)(H,28,30,31)