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

Systemtic Name: methyl 4-methyl-3-[2-(5-oxidanylidene-4-thiophen-2-yl-1,2,3,4-tetrazol-1-yl)ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[5-oxo-4-(2-thienyl)tetrazol-1-yl]acetyl]amino]benzoate CAS Name: 4-methyl-3-[[1-oxo-2-(5-oxo-4-thiophen-2-yl-1-tetrazolyl)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-(5-oxo-4-thiophen-2-yltetrazol-1-yl)acetyl]amino]benzoate Traditional Name: 3-[[2-[5-keto-4-(2-thienyl)tetrazol-1-yl]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C16H15N5O4S MolecularWeight: 373.3864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2C(=O)N(N=N2)C3=CC=CS3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN2C(=O)N(N=N2)C3=CC=CS3

InChI

InChI=1S/C16H15N5O4S/c1-10-5-6-11(15(23)25-2)8-12(10)17-13(22)9-20-16(24)21(19-18-20)14-4-3-7-26-14/h3-8H,9H2,1-2H3,(H,17,22)