5-(3-azanylpropyl)-3-(5-chloranyl-2-fluoranyl-phenyl)-N,N-dimethyl-5-phenyl-2H-pyrrole-1-carboxamide

Systemtic Name: 5-(3-azanylpropyl)-3-(5-chloranyl-2-fluoranyl-phenyl)-N,N-dimethyl-5-phenyl-2H-pyrrole-1-carboxamide Openeye Name: 5-(3-aminopropyl)-3-(5-chloro-2-fluoro-phenyl)-N,N-dimethyl-5-phenyl-2H-pyrrole-1-carboxamide CAS Name: 5-(3-aminopropyl)-3-(5-chloro-2-fluorophenyl)-N,N-dimethyl-5-phenyl-2H-pyrrole-1-carboxamide IUPAC Name: 5-(3-aminopropyl)-3-(5-chloro-2-fluorophenyl)-N,N-dimethyl-5-phenyl-2H-pyrrole-1-carboxamide Traditional Name: 2-(3-aminopropyl)-4-(5-chloro-2-fluoro-phenyl)-N,N-dimethyl-2-phenyl-3-pyrroline-1-carboxamide Formula: C22H25ClFN3O MolecularWeight: 401.904803

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)N1CC(=CC1(CCCN)C2=CC=CC=C2)C3=C(C=CC(=C3)Cl)F

Isomeric SMILES

CN(C)C(=O)N1CC(=CC1(CCCN)C2=CC=CC=C2)C3=C(C=CC(=C3)Cl)F

InChI

InChI=1S/C22H25ClFN3O/c1-26(2)21(28)27-15-16(19-13-18(23)9-10-20(19)24)14-22(27,11-6-12-25)17-7-4-3-5-8-17/h3-5,7-10,13-14H,6,11-12,15,25H2,1-2H3