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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)CN2N=C(N=N2)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)CN2N=C(N=N2)C3=CC=CC=C3)C

InChI

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