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

Systemtic Name: 2-[[5-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[5-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[5-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[5-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[5-(3,4-dihydro-2H-quinolin-1-yl)-4-methyl-1,2,4-triazol-3-yl]thio]acetic acid Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC(=O)O)N2CCCC3=CC=CC=C32

Isomeric SMILES

CN1C(=NN=C1SCC(=O)O)N2CCCC3=CC=CC=C32

InChI

InChI=1S/C14H16N4O2S/c1-17-13(15-16-14(17)21-9-12(19)20)18-8-4-6-10-5-2-3-7-11(10)18/h2-3,5,7H,4,6,8-9H2,1H3,(H,19,20)