6-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]pyridazine-3-carboxamide

Systemtic Name: 6-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]pyridazine-3-carboxamide Openeye Name: 6-[(2-benzyloxy-5-bromo-phenyl)methyl-ethyl-amino]pyridazine-3-carboxamide CAS Name: 6-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-3-pyridazinecarboxamide IUPAC Name: 6-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]pyridazine-3-carboxamide Traditional Name: 6-[(2-benzoxy-5-bromo-benzyl)-ethyl-amino]pyridazine-3-carboxamide Formula: C21H21BrN4O2 MolecularWeight: 441.32104

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=NN=C(C=C3)C(=O)N

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)Br)OCC2=CC=CC=C2)C3=NN=C(C=C3)C(=O)N

InChI

InChI=1S/C21H21BrN4O2/c1-2-26(20-11-9-18(21(23)27)24-25-20)13-16-12-17(22)8-10-19(16)28-14-15-6-4-3-5-7-15/h3-12H,2,13-14H2,1H3,(H2,23,27)