ethyl 2-[(2-methyl-6-methylidene-5-oxidanylidene-1,2,4-triazin-2-ium-3-yl)sulfanyl]ethanoate

Systemtic Name: ethyl 2-[(2-methyl-6-methylidene-5-oxidanylidene-1,2,4-triazin-2-ium-3-yl)sulfanyl]ethanoate Openeye Name: ethyl 2-[(2-methyl-6-methylene-5-oxo-1,2,4-triazin-2-ium-3-yl)sulfanyl]acetate CAS Name: 2-[(2-methyl-6-methylene-5-oxo-1,2,4-triazin-2-ium-3-yl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2-methyl-6-methylidene-5-oxo-1,2,4-triazin-2-ium-3-yl)sulfanyl]acetate Traditional Name: 2-[(5-keto-2-methyl-6-methylene-1,2,4-triazin-2-ium-3-yl)thio]acetic acid ethyl ester Formula: C9H12N3O3S+ MolecularWeight: 242.27488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=O)C(=C)N=[N+]1C

Isomeric SMILES

CCOC(=O)CSC1=NC(=O)C(=C)N=[N+]1C

InChI

InChI=1S/C9H12N3O3S/c1-4-15-7(13)5-16-9-10-8(14)6(2)11-12(9)3/h2,4-5H2,1,3H3/q+1