tert-butyl 2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoate

Systemtic Name: tert-butyl 2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoate Openeye Name: tert-butyl 2-[5-oxo-4-(2-thienyl)tetrazol-1-yl]acetate CAS Name: 2-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(5-oxo-4-thiophen-2-yltetrazol-1-yl)acetate Traditional Name: 2-[5-keto-4-(2-thienyl)tetrazol-1-yl]acetic acid tert-butyl ester Formula: C11H14N4O3S MolecularWeight: 282.31886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N4O3S/c1-11(2,3)18-9(16)7-14-10(17)15(13-12-14)8-5-4-6-19-8/h4-6H,7H2,1-3H3