2-[[4-(1-methylpiperidin-4-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[4-(1-methylpiperidin-4-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[4-(1-methyl-4-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[4-(1-methyl-4-piperidinyl)-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[4-(1-methylpiperidin-4-yl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[4-(1-methyl-4-piperidyl)-1,2,4-triazol-3-yl]thio]acetic acid Formula: C10H16N4O2S MolecularWeight: 256.32464

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N2C=NN=C2SCC(=O)O

Isomeric SMILES

CN1CCC(CC1)N2C=NN=C2SCC(=O)O

InChI

InChI=1S/C10H16N4O2S/c1-13-4-2-8(3-5-13)14-7-11-12-10(14)17-6-9(15)16/h7-8H,2-6H2,1H3,(H,15,16)