methyl 2-[[5-oxidanylidene-6-(phenylmethyl)-2H-1,2,4-triazin-3-yl]sulfanyl]ethanoate

Systemtic Name: methyl 2-[[5-oxidanylidene-6-(phenylmethyl)-2H-1,2,4-triazin-3-yl]sulfanyl]ethanoate Openeye Name: methyl 2-[(6-benzyl-5-oxo-2H-1,2,4-triazin-3-yl)sulfanyl]acetate CAS Name: 2-[[5-oxo-6-(phenylmethyl)-2H-1,2,4-triazin-3-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[(6-benzyl-5-oxo-2H-1,2,4-triazin-3-yl)sulfanyl]acetate Traditional Name: 2-[(6-benzyl-5-keto-2H-1,2,4-triazin-3-yl)thio]acetic acid methyl ester Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC(=O)C(=NN1)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)CSC1=NC(=O)C(=NN1)CC2=CC=CC=C2

InChI

InChI=1S/C13H13N3O3S/c1-19-11(17)8-20-13-14-12(18)10(15-16-13)7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,14,16,18)