3-azanyl-5-bromanyl-4-[(3-butoxy-4-methoxy-phenyl)methylamino]-1H-pyridazin-6-one

Systemtic Name: 3-azanyl-5-bromanyl-4-[(3-butoxy-4-methoxy-phenyl)methylamino]-1H-pyridazin-6-one Openeye Name: 3-amino-5-bromo-4-[(3-butoxy-4-methoxy-phenyl)methylamino]-1H-pyridazin-6-one CAS Name: 3-amino-5-bromo-4-[(3-butoxy-4-methoxyphenyl)methylamino]-1H-pyridazin-6-one IUPAC Name: 3-amino-5-bromo-4-[(3-butoxy-4-methoxyphenyl)methylamino]-1H-pyridazin-6-one Traditional Name: 3-amino-5-bromo-4-[(3-butoxy-4-methoxy-benzyl)amino]-1H-pyridazin-6-one Formula: C16H21BrN4O3 MolecularWeight: 397.26694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21BrN4O3/c1-3-4-7-24-12-8-10(5-6-11(12)23-2)9-19-14-13(17)16(22)21-20-15(14)18/h5-6,8H,3-4,7,9H2,1-2H3,(H2,18,20)(H2,19,21,22)