N-(2-methylbutan-2-yl)-1-[4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-methylbutan-2-yl)-1-[4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1,1-dimethylpropyl)-1-[4-(tetrazol-1-yl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(2-methylbutan-2-yl)-1-[4-(1-tetrazolyl)phenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-methylbutan-2-yl)-1-[4-(tetrazol-1-yl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-tert-amyl-1-[4-(tetrazol-1-yl)phenyl]sulfonyl-isonipecotamide Formula: C18H26N6O3S MolecularWeight: 406.50244

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N3C=NN=N3

Isomeric SMILES

CCC(C)(C)NC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N3C=NN=N3

InChI

InChI=1S/C18H26N6O3S/c1-4-18(2,3)20-17(25)14-9-11-23(12-10-14)28(26,27)16-7-5-15(6-8-16)24-13-19-21-22-24/h5-8,13-14H,4,9-12H2,1-3H3,(H,20,25)