2-[methyl-(4-thiophen-2-ylphenyl)amino]ethanoic acid; 1H-1,2,4-triazole

Systemtic Name: 2-[methyl-(4-thiophen-2-ylphenyl)amino]ethanoic acid; 1H-1,2,4-triazole Openeye Name: 2-[N-methyl-4-(2-thienyl)anilino]acetic acid; 1H-1,2,4-triazole CAS Name: 2-(N-methyl-4-thiophen-2-ylanilino)acetic acid; 1H-1,2,4-triazole IUPAC Name: 2-(N-methyl-4-thiophen-2-ylanilino)acetic acid; 1H-1,2,4-triazole Traditional Name: 2-[N-methyl-4-(2-thienyl)anilino]acetic acid; 1H-1,2,4-triazole Formula: C15H16N4O2S MolecularWeight: 316.37814

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)C1=CC=C(C=C1)C2=CC=CS2.C1=NC=NN1

Isomeric SMILES

CN(CC(=O)O)C1=CC=C(C=C1)C2=CC=CS2.C1=NC=NN1

InChI

InChI=1S/C13H13NO2S.C2H3N3/c1-14(9-13(15)16)11-6-4-10(5-7-11)12-3-2-8-17-12;1-3-2-5-4-1/h2-8H,9H2,1H3,(H,15,16);1-2H,(H,3,4,5)