[1-[1-[2-(3,4-dimethoxyphenyl)-2-oxidanyl-ethyl]piperidin-4-yl]benzimidazol-2-yl]cyanamide

Systemtic Name: [1-[1-[2-(3,4-dimethoxyphenyl)-2-oxidanyl-ethyl]piperidin-4-yl]benzimidazol-2-yl]cyanamide Openeye Name: [1-[1-[2-(3,4-dimethoxyphenyl)-2-hydroxy-ethyl]-4-piperidyl]benzimidazol-2-yl]cyanamide CAS Name: [1-[1-[2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]-4-piperidinyl]-2-benzimidazolyl]cyanamide IUPAC Name: [1-[1-[2-(3,4-dimethoxyphenyl)-2-hydroxyethyl]piperidin-4-yl]benzimidazol-2-yl]cyanamide Traditional Name: [1-[1-[2-(3,4-dimethoxyphenyl)-2-hydroxy-ethyl]-4-piperidyl]benzimidazol-2-yl]cyanamide Formula: C23H27N5O3 MolecularWeight: 421.49218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CN2CCC(CC2)N3C4=CC=CC=C4N=C3NC#N)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CN2CCC(CC2)N3C4=CC=CC=C4N=C3NC#N)O)OC

InChI

InChI=1S/C23H27N5O3/c1-30-21-8-7-16(13-22(21)31-2)20(29)14-27-11-9-17(10-12-27)28-19-6-4-3-5-18(19)26-23(28)25-15-24/h3-8,13,17,20,29H,9-12,14H2,1-2H3,(H,25,26)