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

Systemtic Name: ethyl 4-[2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[5-(3-thienyl)tetrazol-2-yl]acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-[5-(3-thiophenyl)-2-tetrazolyl]ethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(5-thiophen-3-yltetrazol-2-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-[5-(3-thienyl)tetrazol-2-yl]acetyl]amino]benzoic acid ethyl ester Formula: C16H15N5O3S MolecularWeight: 357.387

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2N=C(N=N2)C3=CSC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2N=C(N=N2)C3=CSC=C3

InChI

InChI=1S/C16H15N5O3S/c1-2-24-16(23)11-3-5-13(6-4-11)17-14(22)9-21-19-15(18-20-21)12-7-8-25-10-12/h3-8,10H,2,9H2,1H3,(H,17,22)