ethyl 4-[2-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)thio]acetyl]amino]benzoic acid ethyl ester Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C)SCC(=O)NC2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCC1=NN=C(N1C)SCC(=O)NC2=CC=C(C=C2)C(=O)OCC

InChI

InChI=1S/C16H20N4O3S/c1-4-13-18-19-16(20(13)3)24-10-14(21)17-12-8-6-11(7-9-12)15(22)23-5-2/h6-9H,4-5,10H2,1-3H3,(H,17,21)