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

Systemtic Name: 2-[[4-azanyl-5-(4-dimethylaminophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[4-amino-5-(4-dimethylaminophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid CAS Name: 2-[[4-amino-5-(4-dimethylaminophenyl)-1,2,4-triazol-3-yl]thio]acetic acid IUPAC Name: 2-[[4-amino-5-(4-dimethylaminophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[4-amino-5-(4-dimethylaminophenyl)-1,2,4-triazol-3-yl]thio]acetic acid Formula: C12H15N5O2S MolecularWeight: 293.3448

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NN=C(N2N)SCC(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NN=C(N2N)SCC(=O)O

InChI

InChI=1S/C12H15N5O2S/c1-16(2)9-5-3-8(4-6-9)11-14-15-12(17(11)13)20-7-10(18)19/h3-6H,7,13H2,1-2H3,(H,18,19)