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

Systemtic Name: 3-methyl-2-[2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanoylamino]butanoic acid Openeye Name: 3-methyl-2-[[2-[5-(3-thienyl)tetrazol-2-yl]acetyl]amino]butanoic acid CAS Name: 3-methyl-2-[[1-oxo-2-[5-(3-thiophenyl)-2-tetrazolyl]ethyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[[2-(5-thiophen-3-yltetrazol-2-yl)acetyl]amino]butanoic acid Traditional Name: 3-methyl-2-[[2-[5-(3-thienyl)tetrazol-2-yl]acetyl]amino]butyric acid Formula: C12H15N5O3S MolecularWeight: 309.3442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N5O3S/c1-7(2)10(12(19)20)13-9(18)5-17-15-11(14-16-17)8-3-4-21-6-8/h3-4,6-7,10H,5H2,1-2H3,(H,13,18)(H,19,20)