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

Systemtic Name: methyl 2-methyl-2-[2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoylamino]propanoate Openeye Name: methyl 2-methyl-2-[[2-[5-oxo-4-(2-thienyl)tetrazol-1-yl]acetyl]amino]propanoate CAS Name: 2-methyl-2-[[1-oxo-2-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)ethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[[2-(5-oxo-4-thiophen-2-yltetrazol-1-yl)acetyl]amino]propanoate Traditional Name: 2-[[2-[5-keto-4-(2-thienyl)tetrazol-1-yl]acetyl]amino]-2-methyl-propionic acid methyl ester Formula: C12H15N5O4S MolecularWeight: 325.3436

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC)NC(=O)CN1C(=O)N(N=N1)C2=CC=CS2

Isomeric SMILES

CC(C)(C(=O)OC)NC(=O)CN1C(=O)N(N=N1)C2=CC=CS2

InChI

InChI=1S/C12H15N5O4S/c1-12(2,10(19)21-3)13-8(18)7-16-11(20)17(15-14-16)9-5-4-6-22-9/h4-6H,7H2,1-3H3,(H,13,18)