methyl 4-[(4,6-dimethoxy-1,3,5-triazin-2-yl)sulfanyl]benzoate

Systemtic Name: methyl 4-[(4,6-dimethoxy-1,3,5-triazin-2-yl)sulfanyl]benzoate Openeye Name: methyl 4-[(4,6-dimethoxy-1,3,5-triazin-2-yl)sulfanyl]benzoate CAS Name: 4-[(4,6-dimethoxy-1,3,5-triazin-2-yl)thio]benzoic acid methyl ester IUPAC Name: methyl 4-[(4,6-dimethoxy-1,3,5-triazin-2-yl)sulfanyl]benzoate Traditional Name: 4-[(4,6-dimethoxy-s-triazin-2-yl)thio]benzoic acid methyl ester Formula: C13H13N3O4S MolecularWeight: 307.32502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=N1)SC2=CC=C(C=C2)C(=O)OC)OC

Isomeric SMILES

COC1=NC(=NC(=N1)SC2=CC=C(C=C2)C(=O)OC)OC

InChI

InChI=1S/C13H13N3O4S/c1-18-10(17)8-4-6-9(7-5-8)21-13-15-11(19-2)14-12(16-13)20-3/h4-7H,1-3H3