2-[2-tert-butyl-1-(oxan-4-ylmethyl)benzimidazol-5-yl]sulfonylethanamine

Systemtic Name: 2-[2-tert-butyl-1-(oxan-4-ylmethyl)benzimidazol-5-yl]sulfonylethanamine Openeye Name: 2-[2-tert-butyl-1-(tetrahydropyran-4-ylmethyl)benzimidazol-5-yl]sulfonylethanamine CAS Name: 2-[[2-tert-butyl-1-(4-oxanylmethyl)-5-benzimidazolyl]sulfonyl]ethanamine IUPAC Name: 2-[2-tert-butyl-1-(oxan-4-ylmethyl)benzimidazol-5-yl]sulfonylethanamine Traditional Name: 2-[2-tert-butyl-1-(tetrahydropyran-4-ylmethyl)benzimidazol-5-yl]sulfonylethylamine Formula: C19H29N3O3S MolecularWeight: 379.51686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC2=C(N1CC3CCOCC3)C=CC(=C2)S(=O)(=O)CCN

Isomeric SMILES

CC(C)(C)C1=NC2=C(N1CC3CCOCC3)C=CC(=C2)S(=O)(=O)CCN

InChI

InChI=1S/C19H29N3O3S/c1-19(2,3)18-21-16-12-15(26(23,24)11-8-20)4-5-17(16)22(18)13-14-6-9-25-10-7-14/h4-5,12,14H,6-11,13,20H2,1-3H3