6-azanyl-4-bromanyl-5-[(3-butoxy-4-methoxy-phenyl)methylamino]-2-ethyl-pyridazin-3-one

Systemtic Name: 6-azanyl-4-bromanyl-5-[(3-butoxy-4-methoxy-phenyl)methylamino]-2-ethyl-pyridazin-3-one Openeye Name: 6-amino-4-bromo-5-[(3-butoxy-4-methoxy-phenyl)methylamino]-2-ethyl-pyridazin-3-one CAS Name: 6-amino-4-bromo-5-[(3-butoxy-4-methoxyphenyl)methylamino]-2-ethyl-3-pyridazinone IUPAC Name: 6-amino-4-bromo-5-[(3-butoxy-4-methoxyphenyl)methylamino]-2-ethylpyridazin-3-one Traditional Name: 6-amino-4-bromo-5-[(3-butoxy-4-methoxy-benzyl)amino]-2-ethyl-pyridazin-3-one Formula: C18H25BrN4O3 MolecularWeight: 425.3201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)CNC2=C(C(=O)N(N=C2N)CC)Br)OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)CNC2=C(C(=O)N(N=C2N)CC)Br)OC

InChI

InChI=1S/C18H25BrN4O3/c1-4-6-9-26-14-10-12(7-8-13(14)25-3)11-21-16-15(19)18(24)23(5-2)22-17(16)20/h7-8,10,21H,4-6,9,11H2,1-3H3,(H2,20,22)