phenacyl 3-(1,2,3,4-tetrazol-1-yl)thiophene-2-carboxylate

Systemtic Name: phenacyl 3-(1,2,3,4-tetrazol-1-yl)thiophene-2-carboxylate Openeye Name: phenacyl 3-(tetrazol-1-yl)thiophene-2-carboxylate CAS Name: 3-(1-tetrazolyl)-2-thiophenecarboxylic acid phenacyl ester IUPAC Name: phenacyl 3-(tetrazol-1-yl)thiophene-2-carboxylate Traditional Name: 3-(tetrazol-1-yl)thiophene-2-carboxylic acid phenacyl ester Formula: C14H10N4O3S MolecularWeight: 314.3192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C2=C(C=CS2)N3C=NN=N3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)C2=C(C=CS2)N3C=NN=N3

InChI

InChI=1S/C14H10N4O3S/c19-12(10-4-2-1-3-5-10)8-21-14(20)13-11(6-7-22-13)18-9-15-16-17-18/h1-7,9H,8H2