N-(3,5-dimethylphenyl)-4-[1-(3,4-dimethylphenyl)-6-oxidanylidene-pyridazin-3-yl]piperazine-1-carboxamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-[1-(3,4-dimethylphenyl)-6-oxidanylidene-pyridazin-3-yl]piperazine-1-carboxamide Openeye Name: N-(3,5-dimethylphenyl)-4-[1-(3,4-dimethylphenyl)-6-oxo-pyridazin-3-yl]piperazine-1-carboxamide CAS Name: N-(3,5-dimethylphenyl)-4-[1-(3,4-dimethylphenyl)-6-oxo-3-pyridazinyl]-1-piperazinecarboxamide IUPAC Name: N-(3,5-dimethylphenyl)-4-[1-(3,4-dimethylphenyl)-6-oxopyridazin-3-yl]piperazine-1-carboxamide Traditional Name: N-(3,5-dimethylphenyl)-4-[1-(3,4-dimethylphenyl)-6-keto-pyridazin-3-yl]piperazine-1-carboxamide Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C=CC(=N2)N3CCN(CC3)C(=O)NC4=CC(=CC(=C4)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C=CC(=N2)N3CCN(CC3)C(=O)NC4=CC(=CC(=C4)C)C)C

InChI

InChI=1S/C25H29N5O2/c1-17-13-18(2)15-21(14-17)26-25(32)29-11-9-28(10-12-29)23-7-8-24(31)30(27-23)22-6-5-19(3)20(4)16-22/h5-8,13-16H,9-12H2,1-4H3,(H,26,32)