N-[(2S)-1-[(1-ethylbenzimidazol-2-yl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[(2S)-1-[(1-ethylbenzimidazol-2-yl)methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzamide Openeye Name: N-[(1S)-1-[(1-ethylbenzimidazol-2-yl)methylcarbamoyl]-2-methyl-propyl]-4-fluoro-benzamide CAS Name: N-[(2S)-1-[(1-ethyl-2-benzimidazolyl)methylamino]-3-methyl-1-oxobutan-2-yl]-4-fluorobenzamide IUPAC Name: N-[(2S)-1-[(1-ethylbenzimidazol-2-yl)methylamino]-3-methyl-1-oxobutan-2-yl]-4-fluorobenzamide Traditional Name: N-[(1S)-1-[(1-ethylbenzimidazol-2-yl)methylcarbamoyl]-2-methyl-propyl]-4-fluoro-benzamide Formula: C22H25FN4O2 MolecularWeight: 396.457903

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1CNC(=O)C(C(C)C)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1CNC(=O)[C@H](C(C)C)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H25FN4O2/c1-4-27-18-8-6-5-7-17(18)25-19(27)13-24-22(29)20(14(2)3)26-21(28)15-9-11-16(23)12-10-15/h5-12,14,20H,4,13H2,1-3H3,(H,24,29)(H,26,28)/t20-/m0/s1