ethyl 5-[[2-(1,2,3,4-tetrazol-1-yl)phenyl]carbonylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 5-[[2-(1,2,3,4-tetrazol-1-yl)phenyl]carbonylamino]-1-benzothiophene-2-carboxylate Openeye Name: ethyl 5-[[2-(tetrazol-1-yl)benzoyl]amino]benzothiophene-2-carboxylate CAS Name: 5-[[oxo-[2-(1-tetrazolyl)phenyl]methyl]amino]-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-(tetrazol-1-yl)benzoyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[[2-(tetrazol-1-yl)benzoyl]amino]benzothiophene-2-carboxylic acid ethyl ester Formula: C19H15N5O3S MolecularWeight: 393.4191

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)C3=CC=CC=C3N4C=NN=N4

Isomeric SMILES

CCOC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)C3=CC=CC=C3N4C=NN=N4

InChI

InChI=1S/C19H15N5O3S/c1-2-27-19(26)17-10-12-9-13(7-8-16(12)28-17)21-18(25)14-5-3-4-6-15(14)24-11-20-22-23-24/h3-11H,2H2,1H3,(H,21,25)