N-cycloheptyl-2-[[6-(4-methylphenyl)-7-oxidanylidene-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]sulfanyl]ethanamide

Systemtic Name: N-cycloheptyl-2-[[6-(4-methylphenyl)-7-oxidanylidene-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]sulfanyl]ethanamide Openeye Name: N-cycloheptyl-2-[[7-oxo-6-(p-tolyl)-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]sulfanyl]acetamide CAS Name: N-cycloheptyl-2-[[6-(4-methylphenyl)-7-oxo-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]thio]acetamide IUPAC Name: N-cycloheptyl-2-[[6-(4-methylphenyl)-7-oxo-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]sulfanyl]acetamide Traditional Name: N-cycloheptyl-2-[[7-keto-6-(p-tolyl)-1H-[1,2,4]triazolo[4,3-b][1,2,4]triazin-3-yl]thio]acetamide Formula: C20H24N6O2S MolecularWeight: 412.50856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN3C(=NC2=O)NN=C3SCC(=O)NC4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN3C(=NC2=O)NN=C3SCC(=O)NC4CCCCCC4

InChI

InChI=1S/C20H24N6O2S/c1-13-8-10-14(11-9-13)17-18(28)22-19-23-24-20(26(19)25-17)29-12-16(27)21-15-6-4-2-3-5-7-15/h8-11,15H,2-7,12H2,1H3,(H,21,27)(H,22,23,28)