methyl 2-[methyl-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)amino]ethanoate

Systemtic Name: methyl 2-[methyl-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)amino]ethanoate Openeye Name: methyl 2-[(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-methyl-amino]acetate CAS Name: 2-[methyl-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)amino]acetic acid methyl ester IUPAC Name: methyl 2-[methyl-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)amino]acetate Traditional Name: 2-[(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-methyl-amino]acetic acid methyl ester Formula: C9H14N4O2S MolecularWeight: 242.29806

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC)C1=NNC(=S)N1CC=C

Isomeric SMILES

CN(CC(=O)OC)C1=NNC(=S)N1CC=C

InChI

InChI=1S/C9H14N4O2S/c1-4-5-13-8(10-11-9(13)16)12(2)6-7(14)15-3/h4H,1,5-6H2,2-3H3,(H,11,16)