N-[4-[(2S)-2-oxidanyl-3-[2-(phenylmethyl)benzimidazol-1-yl]propoxy]phenyl]ethanamide

Systemtic Name: N-[4-[(2S)-2-oxidanyl-3-[2-(phenylmethyl)benzimidazol-1-yl]propoxy]phenyl]ethanamide Openeye Name: N-[4-[(2S)-3-(2-benzylbenzimidazol-1-yl)-2-hydroxy-propoxy]phenyl]acetamide CAS Name: N-[4-[(2S)-2-hydroxy-3-[2-(phenylmethyl)-1-benzimidazolyl]propoxy]phenyl]acetamide IUPAC Name: N-[4-[(2S)-3-(2-benzylbenzimidazol-1-yl)-2-hydroxypropoxy]phenyl]acetamide Traditional Name: N-[4-[(2S)-3-(2-benzylbenzimidazol-1-yl)-2-hydroxy-propoxy]phenyl]acetamide Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OCC(CN2C3=CC=CC=C3N=C2CC4=CC=CC=C4)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC[C@H](CN2C3=CC=CC=C3N=C2CC4=CC=CC=C4)O

InChI

InChI=1S/C25H25N3O3/c1-18(29)26-20-11-13-22(14-12-20)31-17-21(30)16-28-24-10-6-5-9-23(24)27-25(28)15-19-7-3-2-4-8-19/h2-14,21,30H,15-17H2,1H3,(H,26,29)/t21-/m0/s1