[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl] 3-(1,2,3,4-tetrazol-1-yl)thiophene-2-carboxylate

Systemtic Name: [2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl] 3-(1,2,3,4-tetrazol-1-yl)thiophene-2-carboxylate Openeye Name: [2-(4-cyclohexylphenyl)-2-oxo-ethyl] 3-(tetrazol-1-yl)thiophene-2-carboxylate CAS Name: 3-(1-tetrazolyl)-2-thiophenecarboxylic acid [2-(4-cyclohexylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-cyclohexylphenyl)-2-oxoethyl] 3-(tetrazol-1-yl)thiophene-2-carboxylate Traditional Name: 3-(tetrazol-1-yl)thiophene-2-carboxylic acid [2-(4-cyclohexylphenyl)-2-keto-ethyl] ester Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C(=O)COC(=O)C3=C(C=CS3)N4C=NN=N4

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C(=O)COC(=O)C3=C(C=CS3)N4C=NN=N4

InChI

InChI=1S/C20H20N4O3S/c25-18(16-8-6-15(7-9-16)14-4-2-1-3-5-14)12-27-20(26)19-17(10-11-28-19)24-13-21-22-23-24/h6-11,13-14H,1-5,12H2