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

Systemtic Name: 2-[[6-(2-aminophenyl)-5-oxidanylidene-2H-1,2,4-triazin-3-yl]sulfanyl]-N-(2,6-diethylphenyl)ethanamide Openeye Name: 2-[[6-(2-aminophenyl)-5-oxo-2H-1,2,4-triazin-3-yl]sulfanyl]-N-(2,6-diethylphenyl)acetamide CAS Name: 2-[[6-(2-aminophenyl)-5-oxo-2H-1,2,4-triazin-3-yl]thio]-N-(2,6-diethylphenyl)acetamide IUPAC Name: 2-[[6-(2-aminophenyl)-5-oxo-2H-1,2,4-triazin-3-yl]sulfanyl]-N-(2,6-diethylphenyl)acetamide Traditional Name: 2-[[6-(2-aminophenyl)-5-keto-2H-1,2,4-triazin-3-yl]thio]-N-(2,6-diethylphenyl)acetamide Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC(=O)C(=NN2)C3=CC=CC=C3N

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC(=O)C(=NN2)C3=CC=CC=C3N

InChI

InChI=1S/C21H23N5O2S/c1-3-13-8-7-9-14(4-2)18(13)23-17(27)12-29-21-24-20(28)19(25-26-21)15-10-5-6-11-16(15)22/h5-11H,3-4,12,22H2,1-2H3,(H,23,27)(H,24,26,28)