(1-propyl-1,2,3,4-tetrazol-5-yl)methyl 3-(4-methylphenyl)thiophene-2-carboxylate

Systemtic Name: (1-propyl-1,2,3,4-tetrazol-5-yl)methyl 3-(4-methylphenyl)thiophene-2-carboxylate Openeye Name: (1-propyltetrazol-5-yl)methyl 3-(p-tolyl)thiophene-2-carboxylate CAS Name: 3-(4-methylphenyl)-2-thiophenecarboxylic acid (1-propyl-5-tetrazolyl)methyl ester IUPAC Name: (1-propyltetrazol-5-yl)methyl 3-(4-methylphenyl)thiophene-2-carboxylate Traditional Name: 3-(p-tolyl)thiophene-2-carboxylic acid (1-propyltetrazol-5-yl)methyl ester Formula: C17H18N4O2S MolecularWeight: 342.41542

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC(=O)C2=C(C=CS2)C3=CC=C(C=C3)C

Isomeric SMILES

CCCN1C(=NN=N1)COC(=O)C2=C(C=CS2)C3=CC=C(C=C3)C

InChI

InChI=1S/C17H18N4O2S/c1-3-9-21-15(18-19-20-21)11-23-17(22)16-14(8-10-24-16)13-6-4-12(2)5-7-13/h4-8,10H,3,9,11H2,1-2H3