N-[4-[1-[[4-[(4-azanylcyclohexyl)methyl]cyclohexyl]amino]-1-oxidanylidene-propan-2-yl]phenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-[1-[[4-[(4-azanylcyclohexyl)methyl]cyclohexyl]amino]-1-oxidanylidene-propan-2-yl]phenyl]-4-fluoranyl-benzamide Openeye Name: N-[4-[2-[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]amino]-1-methyl-2-oxo-ethyl]phenyl]-4-fluoro-benzamide CAS Name: N-[4-[1-[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]amino]-1-oxopropan-2-yl]phenyl]-4-fluorobenzamide IUPAC Name: N-[4-[1-[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]amino]-1-oxopropan-2-yl]phenyl]-4-fluorobenzamide Traditional Name: N-[4-[2-[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]amino]-2-keto-1-methyl-ethyl]phenyl]-4-fluoro-benzamide Formula: C29H38FN3O2 MolecularWeight: 479.629323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)F)C(=O)NC3CCC(CC3)CC4CCC(CC4)N

Isomeric SMILES

CC(C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)F)C(=O)NC3CCC(CC3)CC4CCC(CC4)N

InChI

InChI=1S/C29H38FN3O2/c1-19(22-8-16-27(17-9-22)33-29(35)23-6-10-24(30)11-7-23)28(34)32-26-14-4-21(5-15-26)18-20-2-12-25(31)13-3-20/h6-11,16-17,19-21,25-26H,2-5,12-15,18,31H2,1H3,(H,32,34)(H,33,35)