hexyl 4-[2-[(6-methyl-5-oxidanylidene-2H-1,2,4-triazin-3-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: hexyl 4-[2-[(6-methyl-5-oxidanylidene-2H-1,2,4-triazin-3-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: hexyl 4-[[2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)thio]-1-oxoethyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[[2-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(5-keto-6-methyl-2H-1,2,4-triazin-3-yl)thio]acetyl]amino]benzoic acid hexyl ester Formula: C19H24N4O4S MolecularWeight: 404.48326

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C(=NN2)C

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C(=NN2)C

InChI

InChI=1S/C19H24N4O4S/c1-3-4-5-6-11-27-18(26)14-7-9-15(10-8-14)20-16(24)12-28-19-21-17(25)13(2)22-23-19/h7-10H,3-6,11-12H2,1-2H3,(H,20,24)(H,21,23,25)