ethyl 3-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 3-[[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)thio]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 3-[[2-[(5,6-dimethyl-1,2,4-triazin-3-yl)thio]acetyl]amino]benzoic acid ethyl ester Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC(=C(N=N2)C)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC(=C(N=N2)C)C

InChI

InChI=1S/C16H18N4O3S/c1-4-23-15(22)12-6-5-7-13(8-12)18-14(21)9-24-16-17-10(2)11(3)19-20-16/h5-8H,4,9H2,1-3H3,(H,18,21)