N-[4-[[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]amino]phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-[[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]amino]phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-[[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]amino]phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-[[6-(3-methyl-1-pyrazolyl)-3-pyridazinyl]amino]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-[[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]amino]phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-[[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]amino]phenyl]-piperonylamide Formula: C22H18N6O3 MolecularWeight: 414.41672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)C2=NN=C(C=C2)NC3=CC=C(C=C3)NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=NN(C=C1)C2=NN=C(C=C2)NC3=CC=C(C=C3)NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H18N6O3/c1-14-10-11-28(27-14)21-9-8-20(25-26-21)23-16-3-5-17(6-4-16)24-22(29)15-2-7-18-19(12-15)31-13-30-18/h2-12H,13H2,1H3,(H,23,25)(H,24,29)