N-[(4-carbamimidoylphenyl)methyl]-2-[3-methyl-6-(methylsulfonylamino)-5-oxidanylidene-1,2,4-triazin-4-yl]ethanamide

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-[3-methyl-6-(methylsulfonylamino)-5-oxidanylidene-1,2,4-triazin-4-yl]ethanamide Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-[6-(methanesulfonamido)-3-methyl-5-oxo-1,2,4-triazin-4-yl]acetamide CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-[6-(methanesulfonamido)-3-methyl-5-oxo-1,2,4-triazin-4-yl]acetamide IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-[6-(methanesulfonamido)-3-methyl-5-oxo-1,2,4-triazin-4-yl]acetamide Traditional Name: N-(4-amidinobenzyl)-2-[5-keto-6-(methanesulfonamido)-3-methyl-1,2,4-triazin-4-yl]acetamide Formula: C15H19N7O4S MolecularWeight: 393.42086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C(=O)N1CC(=O)NCC2=CC=C(C=C2)C(=N)N)NS(=O)(=O)C

Isomeric SMILES

CC1=NN=C(C(=O)N1CC(=O)NCC2=CC=C(C=C2)C(=N)N)NS(=O)(=O)C

InChI

InChI=1S/C15H19N7O4S/c1-9-19-20-14(21-27(2,25)26)15(24)22(9)8-12(23)18-7-10-3-5-11(6-4-10)13(16)17/h3-6H,7-8H2,1-2H3,(H3,16,17)(H,18,23)(H,20,21)