N-[3-[[3-azanylpropyl(cyclopropylcarbonyl)amino]methyl]-4-chloranyl-phenyl]-3-fluoranyl-benzamide

Systemtic Name: N-[3-[[3-azanylpropyl(cyclopropylcarbonyl)amino]methyl]-4-chloranyl-phenyl]-3-fluoranyl-benzamide Openeye Name: N-[3-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]-4-chloro-phenyl]-3-fluoro-benzamide CAS Name: N-[3-[[3-aminopropyl-[cyclopropyl(oxo)methyl]amino]methyl]-4-chlorophenyl]-3-fluorobenzamide IUPAC Name: N-[3-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]-4-chlorophenyl]-3-fluorobenzamide Traditional Name: N-[3-[[3-aminopropyl(cyclopropanecarbonyl)amino]methyl]-4-chloro-phenyl]-3-fluoro-benzamide Formula: C21H23ClFN3O2 MolecularWeight: 403.877623

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N(CCCN)CC2=C(C=CC(=C2)NC(=O)C3=CC(=CC=C3)F)Cl

Isomeric SMILES

C1CC1C(=O)N(CCCN)CC2=C(C=CC(=C2)NC(=O)C3=CC(=CC=C3)F)Cl

InChI

InChI=1S/C21H23ClFN3O2/c22-19-8-7-18(25-20(27)15-3-1-4-17(23)11-15)12-16(19)13-26(10-2-9-24)21(28)14-5-6-14/h1,3-4,7-8,11-12,14H,2,5-6,9-10,13,24H2,(H,25,27)