N-[(2S)-1-[[4-(azepan-1-yl)phenyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]-2-fluoranyl-benzamide

Systemtic Name: N-[(2S)-1-[[4-(azepan-1-yl)phenyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]-2-fluoranyl-benzamide Openeye Name: N-[(1S)-1-[[4-(azepan-1-yl)phenyl]carbamoyl]-2-methyl-propyl]-2-fluoro-benzamide CAS Name: N-[(2S)-1-[4-(1-azepanyl)anilino]-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide IUPAC Name: N-[(2S)-1-[4-(azepan-1-yl)anilino]-3-methyl-1-oxobutan-2-yl]-2-fluorobenzamide Traditional Name: N-[(1S)-1-[[4-(azepan-1-yl)phenyl]carbamoyl]-2-methyl-propyl]-2-fluoro-benzamide Formula: C24H30FN3O2 MolecularWeight: 411.512303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)N2CCCCCC2)NC(=O)C3=CC=CC=C3F

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC=C(C=C1)N2CCCCCC2)NC(=O)C3=CC=CC=C3F

InChI

InChI=1S/C24H30FN3O2/c1-17(2)22(27-23(29)20-9-5-6-10-21(20)25)24(30)26-18-11-13-19(14-12-18)28-15-7-3-4-8-16-28/h5-6,9-14,17,22H,3-4,7-8,15-16H2,1-2H3,(H,26,30)(H,27,29)/t22-/m0/s1