N-(2-azanylcyclohexyl)-N-[[2-chloranyl-5-(cyclopropylcarbonylamino)phenyl]methyl]-3-fluoranyl-benzamide

Systemtic Name: N-(2-azanylcyclohexyl)-N-[[2-chloranyl-5-(cyclopropylcarbonylamino)phenyl]methyl]-3-fluoranyl-benzamide Openeye Name: N-(2-aminocyclohexyl)-N-[[2-chloro-5-(cyclopropanecarbonylamino)phenyl]methyl]-3-fluoro-benzamide CAS Name: N-(2-aminocyclohexyl)-N-[[2-chloro-5-[[cyclopropyl(oxo)methyl]amino]phenyl]methyl]-3-fluorobenzamide IUPAC Name: N-(2-aminocyclohexyl)-N-[[2-chloro-5-(cyclopropanecarbonylamino)phenyl]methyl]-3-fluorobenzamide Traditional Name: N-(2-aminocyclohexyl)-N-[2-chloro-5-(cyclopropanecarbonylamino)benzyl]-3-fluoro-benzamide Formula: C24H27ClFN3O2 MolecularWeight: 443.941483

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)N(CC2=C(C=CC(=C2)NC(=O)C3CC3)Cl)C(=O)C4=CC(=CC=C4)F

Isomeric SMILES

C1CCC(C(C1)N)N(CC2=C(C=CC(=C2)NC(=O)C3CC3)Cl)C(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C24H27ClFN3O2/c25-20-11-10-19(28-23(30)15-8-9-15)13-17(20)14-29(22-7-2-1-6-21(22)27)24(31)16-4-3-5-18(26)12-16/h3-5,10-13,15,21-22H,1-2,6-9,14,27H2,(H,28,30)