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

Systemtic Name: methyl 4,5-dimethoxy-2-[2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[[2-[5-oxo-4-(2-thienyl)tetrazol-1-yl]acetyl]amino]benzoate CAS Name: 4,5-dimethoxy-2-[[1-oxo-2-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[[2-(5-oxo-4-thiophen-2-yltetrazol-1-yl)acetyl]amino]benzoate Traditional Name: 2-[[2-[5-keto-4-(2-thienyl)tetrazol-1-yl]acetyl]amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C17H17N5O6S MolecularWeight: 419.41178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CN2C(=O)N(N=N2)C3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CN2C(=O)N(N=N2)C3=CC=CS3)OC

InChI

InChI=1S/C17H17N5O6S/c1-26-12-7-10(16(24)28-3)11(8-13(12)27-2)18-14(23)9-21-17(25)22(20-19-21)15-5-4-6-29-15/h4-8H,9H2,1-3H3,(H,18,23)