2-[2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanoylamino]butanoic acid

Systemtic Name: 2-[2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanoylamino]butanoic acid Openeye Name: 2-[[2-[5-(2-thienyl)tetrazol-2-yl]acetyl]amino]butanoic acid CAS Name: 2-[[1-oxo-2-(5-thiophen-2-yl-2-tetrazolyl)ethyl]amino]butanoic acid IUPAC Name: 2-[[2-(5-thiophen-2-yltetrazol-2-yl)acetyl]amino]butanoic acid Traditional Name: 2-[[2-[5-(2-thienyl)tetrazol-2-yl]acetyl]amino]butyric acid Formula: C11H13N5O3S MolecularWeight: 295.31762

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)CN1N=C(N=N1)C2=CC=CS2

Isomeric SMILES

CCC(C(=O)O)NC(=O)CN1N=C(N=N1)C2=CC=CS2

InChI

InChI=1S/C11H13N5O3S/c1-2-7(11(18)19)12-9(17)6-16-14-10(13-15-16)8-4-3-5-20-8/h3-5,7H,2,6H2,1H3,(H,12,17)(H,18,19)