3-[[4-azanyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate

Systemtic Name: 3-[[4-azanyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate Openeye Name: 3-[[4-amino-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate CAS Name: 3-[[4-amino-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]propanoate IUPAC Name: 3-[[4-amino-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanoate Traditional Name: 3-[[4-amino-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]propionate Formula: C10H11N4O2S2- MolecularWeight: 283.34994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CC2=NN=C(N2N)SCCC(=O)[O-]

Isomeric SMILES

C1=CSC(=C1)CC2=NN=C(N2N)SCCC(=O)[O-]

InChI

InChI=1S/C10H12N4O2S2/c11-14-8(6-7-2-1-4-17-7)12-13-10(14)18-5-3-9(15)16/h1-2,4H,3,5-6,11H2,(H,15,16)/p-1