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

Systemtic Name: 1-[(4-bromanyl-2-chloranyl-phenoxy)methyl]-N-[3-(diethylamino)propyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromo-2-chloro-phenoxy)methyl]-N-[3-(diethylamino)propyl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromo-2-chlorophenoxy)methyl]-N-[3-(diethylamino)propyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromo-2-chlorophenoxy)methyl]-N-[3-(diethylamino)propyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromo-2-chloro-phenoxy)methyl]-N-[3-(diethylamino)propyl]pyrazole-3-carboxamide Formula: C18H24BrClN4O2 MolecularWeight: 443.76576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24BrClN4O2/c1-3-23(4-2)10-5-9-21-18(25)16-8-11-24(22-16)13-26-17-7-6-14(19)12-15(17)20/h6-8,11-12H,3-5,9-10,13H2,1-2H3,(H,21,25)