N-[2-[5-(2,2-dimethylpropanoylamino)-1-methyl-benzimidazol-2-yl]ethyl]-3-fluoranyl-benzamide

Systemtic Name: N-[2-[5-(2,2-dimethylpropanoylamino)-1-methyl-benzimidazol-2-yl]ethyl]-3-fluoranyl-benzamide Openeye Name: N-[2-[5-(2,2-dimethylpropanoylamino)-1-methyl-benzimidazol-2-yl]ethyl]-3-fluoro-benzamide CAS Name: N-[2-[5-[(2,2-dimethyl-1-oxopropyl)amino]-1-methyl-2-benzimidazolyl]ethyl]-3-fluorobenzamide IUPAC Name: N-[2-[5-(2,2-dimethylpropanoylamino)-1-methylbenzimidazol-2-yl]ethyl]-3-fluorobenzamide Traditional Name: 3-fluoro-N-[2-[1-methyl-5-(pivaloylamino)benzimidazol-2-yl]ethyl]benzamide Formula: C22H25FN4O2 MolecularWeight: 396.457903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC2=C(C=C1)N(C(=N2)CCNC(=O)C3=CC(=CC=C3)F)C

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC2=C(C=C1)N(C(=N2)CCNC(=O)C3=CC(=CC=C3)F)C

InChI

InChI=1S/C22H25FN4O2/c1-22(2,3)21(29)25-16-8-9-18-17(13-16)26-19(27(18)4)10-11-24-20(28)14-6-5-7-15(23)12-14/h5-9,12-13H,10-11H2,1-4H3,(H,24,28)(H,25,29)