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

Systemtic Name: 6-[(5-bromanyl-2-phenylmethoxy-phenyl)methyl-ethyl-amino]-N-propyl-pyridazine-3-carboxamide Openeye Name: 6-[(2-benzyloxy-5-bromo-phenyl)methyl-ethyl-amino]-N-propyl-pyridazine-3-carboxamide CAS Name: 6-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-N-propyl-3-pyridazinecarboxamide IUPAC Name: 6-[(5-bromo-2-phenylmethoxyphenyl)methyl-ethylamino]-N-propylpyridazine-3-carboxamide Traditional Name: 6-[(2-benzoxy-5-bromo-benzyl)-ethyl-amino]-N-propyl-pyridazine-3-carboxamide Formula: C24H27BrN4O2 MolecularWeight: 483.40078

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=NN=C(C=C1)N(CC)CC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3

Isomeric SMILES

CCCNC(=O)C1=NN=C(C=C1)N(CC)CC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C24H27BrN4O2/c1-3-14-26-24(30)21-11-13-23(28-27-21)29(4-2)16-19-15-20(25)10-12-22(19)31-17-18-8-6-5-7-9-18/h5-13,15H,3-4,14,16-17H2,1-2H3,(H,26,30)