ethyl 4-ethyl-5-methyl-2-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-5-methyl-2-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-5-methyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-5-methyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)CN2N=C(N=N2)C3=CC=CC=C3)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)CN2N=C(N=N2)C3=CC=CC=C3)C

InChI

InChI=1S/C19H21N5O3S/c1-4-14-12(3)28-18(16(14)19(26)27-5-2)20-15(25)11-24-22-17(21-23-24)13-9-7-6-8-10-13/h6-10H,4-5,11H2,1-3H3,(H,20,25)