4,5-bis(hydroxymethyl)-2-[[2-(piperidin-4-ylamino)benzimidazol-1-yl]methyl]pyridin-3-ol

Systemtic Name: 4,5-bis(hydroxymethyl)-2-[[2-(piperidin-4-ylamino)benzimidazol-1-yl]methyl]pyridin-3-ol Openeye Name: 4,5-bis(hydroxymethyl)-2-[[2-(4-piperidylamino)benzimidazol-1-yl]methyl]pyridin-3-ol CAS Name: 4,5-bis(hydroxymethyl)-2-[[2-(4-piperidinylamino)-1-benzimidazolyl]methyl]-3-pyridinol IUPAC Name: 4,5-bis(hydroxymethyl)-2-[[2-(piperidin-4-ylamino)benzimidazol-1-yl]methyl]pyridin-3-ol Traditional Name: 4,5-dimethylol-2-[[2-(4-piperidylamino)benzimidazol-1-yl]methyl]pyridin-3-ol Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1NC2=NC3=CC=CC=C3N2CC4=NC=C(C(=C4O)CO)CO

Isomeric SMILES

C1CNCCC1NC2=NC3=CC=CC=C3N2CC4=NC=C(C(=C4O)CO)CO

InChI

InChI=1S/C20H25N5O3/c26-11-13-9-22-17(19(28)15(13)12-27)10-25-18-4-2-1-3-16(18)24-20(25)23-14-5-7-21-8-6-14/h1-4,9,14,21,26-28H,5-8,10-12H2,(H,23,24)