N-(3,4-dimethylphenyl)-4-[6-(pyridin-3-ylamino)pyridazin-3-yl]piperazine-1-carboxamide

Systemtic Name: N-(3,4-dimethylphenyl)-4-[6-(pyridin-3-ylamino)pyridazin-3-yl]piperazine-1-carboxamide Openeye Name: N-(3,4-dimethylphenyl)-4-[6-(3-pyridylamino)pyridazin-3-yl]piperazine-1-carboxamide CAS Name: N-(3,4-dimethylphenyl)-4-[6-(3-pyridinylamino)-3-pyridazinyl]-1-piperazinecarboxamide IUPAC Name: N-(3,4-dimethylphenyl)-4-[6-(pyridin-3-ylamino)pyridazin-3-yl]piperazine-1-carboxamide Traditional Name: N-(3,4-dimethylphenyl)-4-[6-(3-pyridylamino)pyridazin-3-yl]piperazine-1-carboxamide Formula: C22H25N7O MolecularWeight: 403.4802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N7O/c1-16-5-6-18(14-17(16)2)25-22(30)29-12-10-28(11-13-29)21-8-7-20(26-27-21)24-19-4-3-9-23-15-19/h3-9,14-15H,10-13H2,1-2H3,(H,24,26)(H,25,30)