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

Systemtic Name: butan-2-yl 4-[2-[(6-methyl-5-oxidanylidene-2H-1,2,4-triazin-3-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: sec-butyl 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 butan-2-yl ester IUPAC Name: butan-2-yl 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 sec-butyl ester Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C(=NN2)C

Isomeric SMILES

CCC(C)OC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C(=NN2)C

InChI

InChI=1S/C17H20N4O4S/c1-4-10(2)25-16(24)12-5-7-13(8-6-12)18-14(22)9-26-17-19-15(23)11(3)20-21-17/h5-8,10H,4,9H2,1-3H3,(H,18,22)(H,19,21,23)