[4-(1,2,3,4-tetrazol-1-yl)phenyl] 5-(dimethylsulfamoyl)-2-piperidin-1-yl-benzoate

Systemtic Name: [4-(1,2,3,4-tetrazol-1-yl)phenyl] 5-(dimethylsulfamoyl)-2-piperidin-1-yl-benzoate Openeye Name: [4-(tetrazol-1-yl)phenyl] 5-(dimethylsulfamoyl)-2-(1-piperidyl)benzoate CAS Name: 5-(dimethylsulfamoyl)-2-(1-piperidinyl)benzoic acid [4-(1-tetrazolyl)phenyl] ester IUPAC Name: [4-(tetrazol-1-yl)phenyl] 5-(dimethylsulfamoyl)-2-piperidin-1-ylbenzoate Traditional Name: 5-(dimethylsulfamoyl)-2-piperidino-benzoic acid [4-(tetrazol-1-yl)phenyl] ester Formula: C21H24N6O4S MolecularWeight: 456.51806

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)C(=O)OC3=CC=C(C=C3)N4C=NN=N4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCCC2)C(=O)OC3=CC=C(C=C3)N4C=NN=N4

InChI

InChI=1S/C21H24N6O4S/c1-25(2)32(29,30)18-10-11-20(26-12-4-3-5-13-26)19(14-18)21(28)31-17-8-6-16(7-9-17)27-15-22-23-24-27/h6-11,14-15H,3-5,12-13H2,1-2H3