2-[[6-(2-aminophenyl)-5-oxidanylidene-2H-1,2,4-triazin-3-yl]sulfanyl]-N-cycloheptyl-ethanamide

Systemtic Name: 2-[[6-(2-aminophenyl)-5-oxidanylidene-2H-1,2,4-triazin-3-yl]sulfanyl]-N-cycloheptyl-ethanamide Openeye Name: 2-[[6-(2-aminophenyl)-5-oxo-2H-1,2,4-triazin-3-yl]sulfanyl]-N-cycloheptyl-acetamide CAS Name: 2-[[6-(2-aminophenyl)-5-oxo-2H-1,2,4-triazin-3-yl]thio]-N-cycloheptylacetamide IUPAC Name: 2-[[6-(2-aminophenyl)-5-oxo-2H-1,2,4-triazin-3-yl]sulfanyl]-N-cycloheptylacetamide Traditional Name: 2-[[6-(2-aminophenyl)-5-keto-2H-1,2,4-triazin-3-yl]thio]-N-cycloheptyl-acetamide Formula: C18H23N5O2S MolecularWeight: 373.47252

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CSC2=NC(=O)C(=NN2)C3=CC=CC=C3N

Isomeric SMILES

C1CCCC(CC1)NC(=O)CSC2=NC(=O)C(=NN2)C3=CC=CC=C3N

InChI

InChI=1S/C18H23N5O2S/c19-14-10-6-5-9-13(14)16-17(25)21-18(23-22-16)26-11-15(24)20-12-7-3-1-2-4-8-12/h5-6,9-10,12H,1-4,7-8,11,19H2,(H,20,24)(H,21,23,25)