2-[[5-methyl-4-(1-methylpiperidin-4-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[5-methyl-4-(1-methylpiperidin-4-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[5-methyl-4-(1-methyl-4-piperidyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[5-methyl-4-(1-methyl-4-piperidinyl)-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[5-methyl-4-(1-methylpiperidin-4-yl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[5-methyl-4-(1-methyl-4-piperidyl)-1,2,4-triazol-3-yl]thio]acetic acid Formula: C11H18N4O2S MolecularWeight: 270.35122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCN(CC2)C)SCC(=O)O

Isomeric SMILES

CC1=NN=C(N1C2CCN(CC2)C)SCC(=O)O

InChI

InChI=1S/C11H18N4O2S/c1-8-12-13-11(18-7-10(16)17)15(8)9-3-5-14(2)6-4-9/h9H,3-7H2,1-2H3,(H,16,17)