1-[(4-bromanyl-2-chloranyl-phenoxy)methyl]-N-[3-(dimethylamino)propyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanyl-2-chloranyl-phenoxy)methyl]-N-[3-(dimethylamino)propyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromo-2-chloro-phenoxy)methyl]-N-[3-(dimethylamino)propyl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromo-2-chlorophenoxy)methyl]-N-[3-(dimethylamino)propyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromo-2-chlorophenoxy)methyl]-N-[3-(dimethylamino)propyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromo-2-chloro-phenoxy)methyl]-N-[3-(dimethylamino)propyl]pyrazole-3-carboxamide Formula: C16H20BrClN4O2 MolecularWeight: 415.7126

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=O)C1=NN(C=C1)COC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CN(C)CCCNC(=O)C1=NN(C=C1)COC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C16H20BrClN4O2/c1-21(2)8-3-7-19-16(23)14-6-9-22(20-14)11-24-15-5-4-12(17)10-13(15)18/h4-6,9-10H,3,7-8,11H2,1-2H3,(H,19,23)