2-[2-(quinolin-7-ylmethylsulfanyl)ethylamino]ethanoic acid

Systemtic Name: 2-[2-(quinolin-7-ylmethylsulfanyl)ethylamino]ethanoic acid Openeye Name: 2-[2-(7-quinolylmethylsulfanyl)ethylamino]acetic acid CAS Name: 2-[2-(7-quinolinylmethylthio)ethylamino]acetic acid IUPAC Name: 2-[2-(quinolin-7-ylmethylsulfanyl)ethylamino]acetic acid Traditional Name: 2-[2-(7-quinolylmethylthio)ethylamino]acetic acid Formula: C14H16N2O2S MolecularWeight: 276.35404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C(C=C2)CSCCNCC(=O)O)N=C1

Isomeric SMILES

C1=CC2=C(C=C(C=C2)CSCCNCC(=O)O)N=C1

InChI

InChI=1S/C14H16N2O2S/c17-14(18)9-15-6-7-19-10-11-3-4-12-2-1-5-16-13(12)8-11/h1-5,8,15H,6-7,9-10H2,(H,17,18)