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

Systemtic Name: methyl 2-methoxy-5-[[2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoylamino]methyl]benzoate Openeye Name: methyl 2-methoxy-5-[[[2-[5-oxo-4-(2-thienyl)tetrazol-1-yl]acetyl]amino]methyl]benzoate CAS Name: 2-methoxy-5-[[[1-oxo-2-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)ethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-methoxy-5-[[[2-(5-oxo-4-thiophen-2-yltetrazol-1-yl)acetyl]amino]methyl]benzoate Traditional Name: 5-[[[2-[5-keto-4-(2-thienyl)tetrazol-1-yl]acetyl]amino]methyl]-2-methoxy-benzoic acid methyl ester Formula: C17H17N5O5S MolecularWeight: 403.41238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N5O5S/c1-26-13-6-5-11(8-12(13)16(24)27-2)9-18-14(23)10-21-17(25)22(20-19-21)15-4-3-7-28-15/h3-8H,9-10H2,1-2H3,(H,18,23)