(3,4-dimethylphenyl)-[4-[6-(pyridin-3-ylamino)pyridazin-3-yl]piperazin-1-yl]methanone

Systemtic Name: (3,4-dimethylphenyl)-[4-[6-(pyridin-3-ylamino)pyridazin-3-yl]piperazin-1-yl]methanone Openeye Name: (3,4-dimethylphenyl)-[4-[6-(3-pyridylamino)pyridazin-3-yl]piperazin-1-yl]methanone CAS Name: (3,4-dimethylphenyl)-[4-[6-(3-pyridinylamino)-3-pyridazinyl]-1-piperazinyl]methanone IUPAC Name: (3,4-dimethylphenyl)-[4-[6-(pyridin-3-ylamino)pyridazin-3-yl]piperazin-1-yl]methanone Traditional Name: (3,4-dimethylphenyl)-[4-[6-(3-pyridylamino)pyridazin-3-yl]piperazino]methanone Formula: C22H24N6O MolecularWeight: 388.46556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NN=C(C=C3)NC4=CN=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=NN=C(C=C3)NC4=CN=CC=C4)C

InChI

InChI=1S/C22H24N6O/c1-16-5-6-18(14-17(16)2)22(29)28-12-10-27(11-13-28)21-8-7-20(25-26-21)24-19-4-3-9-23-15-19/h3-9,14-15H,10-13H2,1-2H3,(H,24,25)