methyl 3-[[5-(aminomethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanoate

Systemtic Name: methyl 3-[[5-(aminomethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanoate Openeye Name: methyl 3-[[5-(aminomethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanoate CAS Name: 3-[[5-(aminomethyl)-4-methyl-1,2,4-triazol-3-yl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[[5-(aminomethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanoate Traditional Name: 3-[[5-(aminomethyl)-4-methyl-1,2,4-triazol-3-yl]thio]propionic acid methyl ester Formula: C8H14N4O2S MolecularWeight: 230.28736

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCC(=O)OC)CN

Isomeric SMILES

CN1C(=NN=C1SCCC(=O)OC)CN

InChI

InChI=1S/C8H14N4O2S/c1-12-6(5-9)10-11-8(12)15-4-3-7(13)14-2/h3-5,9H2,1-2H3