1-[2-tert-butyl-1-(oxan-4-ylmethyl)benzimidazol-5-yl]sulfonylpyrazol-3-amine

Systemtic Name: 1-[2-tert-butyl-1-(oxan-4-ylmethyl)benzimidazol-5-yl]sulfonylpyrazol-3-amine Openeye Name: 1-[2-tert-butyl-1-(tetrahydropyran-4-ylmethyl)benzimidazol-5-yl]sulfonylpyrazol-3-amine CAS Name: 1-[[2-tert-butyl-1-(4-oxanylmethyl)-5-benzimidazolyl]sulfonyl]-3-pyrazolamine IUPAC Name: 1-[2-tert-butyl-1-(oxan-4-ylmethyl)benzimidazol-5-yl]sulfonylpyrazol-3-amine Traditional Name: [1-[2-tert-butyl-1-(tetrahydropyran-4-ylmethyl)benzimidazol-5-yl]sulfonylpyrazol-3-yl]amine Formula: C20H27N5O3S MolecularWeight: 417.52508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(N1CC3CCOCC3)C=CC(=C2)S(=O)(=O)N4C=CC(=N4)N

Isomeric SMILES

CC(C)(C)C1=NC2=C(N1CC3CCOCC3)C=CC(=C2)S(=O)(=O)N4C=CC(=N4)N

InChI

InChI=1S/C20H27N5O3S/c1-20(2,3)19-22-16-12-15(29(26,27)25-9-6-18(21)23-25)4-5-17(16)24(19)13-14-7-10-28-11-8-14/h4-6,9,12,14H,7-8,10-11,13H2,1-3H3,(H2,21,23)