N-butyl-3-methyl-7-phenyl-[1,2]oxazolo[4,5-d]pyridazin-4-amine

Systemtic Name: N-butyl-3-methyl-7-phenyl-[1,2]oxazolo[4,5-d]pyridazin-4-amine Openeye Name: N-butyl-3-methyl-7-phenyl-isoxazolo[4,5-d]pyridazin-4-amine CAS Name: N-butyl-3-methyl-7-phenyl-4-isoxazolo[4,5-d]pyridazinamine IUPAC Name: N-butyl-3-methyl-7-phenyl-[1,2]oxazolo[4,5-d]pyridazin-4-amine Traditional Name: butyl-(3-methyl-7-phenyl-isoxazolo[4,5-d]pyridazin-4-yl)amine Formula: C16H18N4O MolecularWeight: 282.34032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NN=C(C2=C1C(=NO2)C)C3=CC=CC=C3

Isomeric SMILES

CCCCNC1=NN=C(C2=C1C(=NO2)C)C3=CC=CC=C3

InChI

InChI=1S/C16H18N4O/c1-3-4-10-17-16-13-11(2)20-21-15(13)14(18-19-16)12-8-6-5-7-9-12/h5-9H,3-4,10H2,1-2H3,(H,17,19)