N-(4-azanylcyclohexyl)-N-[[3-(cyclohexylcarbonylamino)phenyl]methyl]-3-fluoranyl-benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-N-[[3-(cyclohexylcarbonylamino)phenyl]methyl]-3-fluoranyl-benzamide Openeye Name: N-(4-aminocyclohexyl)-N-[[3-(cyclohexanecarbonylamino)phenyl]methyl]-3-fluoro-benzamide CAS Name: N-(4-aminocyclohexyl)-N-[[3-[[cyclohexyl(oxo)methyl]amino]phenyl]methyl]-3-fluorobenzamide IUPAC Name: N-(4-aminocyclohexyl)-N-[[3-(cyclohexanecarbonylamino)phenyl]methyl]-3-fluorobenzamide Traditional Name: N-(4-aminocyclohexyl)-N-[3-(cyclohexanecarbonylamino)benzyl]-3-fluoro-benzamide Formula: C27H34FN3O2 MolecularWeight: 451.576163

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC=CC(=C2)CN(C3CCC(CC3)N)C(=O)C4=CC(=CC=C4)F

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC=CC(=C2)CN(C3CCC(CC3)N)C(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C27H34FN3O2/c28-22-10-5-9-21(17-22)27(33)31(25-14-12-23(29)13-15-25)18-19-6-4-11-24(16-19)30-26(32)20-7-2-1-3-8-20/h4-6,9-11,16-17,20,23,25H,1-3,7-8,12-15,18,29H2,(H,30,32)