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

Systemtic Name: 3-oxidanyl-2-[2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanoylamino]butanoic acid Openeye Name: 3-hydroxy-2-[[2-[5-(2-thienyl)tetrazol-2-yl]acetyl]amino]butanoic acid CAS Name: 3-hydroxy-2-[[1-oxo-2-(5-thiophen-2-yl-2-tetrazolyl)ethyl]amino]butanoic acid IUPAC Name: 3-hydroxy-2-[[2-(5-thiophen-2-yltetrazol-2-yl)acetyl]amino]butanoic acid Traditional Name: 3-hydroxy-2-[[2-[5-(2-thienyl)tetrazol-2-yl]acetyl]amino]butyric acid Formula: C11H13N5O4S MolecularWeight: 311.31702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N5O4S/c1-6(17)9(11(19)20)12-8(18)5-16-14-10(13-15-16)7-3-2-4-21-7/h2-4,6,9,17H,5H2,1H3,(H,12,18)(H,19,20)