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

Systemtic Name: methyl 4,5-dimethyl-2-[2-(5-phenyl-1,2,3,4-tetrazol-2-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[1-oxo-2-(5-phenyl-2-tetrazolyl)ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[2-(5-phenyltetrazol-2-yl)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C17H17N5O3S MolecularWeight: 371.41358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2N=C(N=N2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2N=C(N=N2)C3=CC=CC=C3)C

InChI

InChI=1S/C17H17N5O3S/c1-10-11(2)26-16(14(10)17(24)25-3)18-13(23)9-22-20-15(19-21-22)12-7-5-4-6-8-12/h4-8H,9H2,1-3H3,(H,18,23)