3-[(E)-2-[5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]ethenyl]-4-methyl-6-oxidanylidene-1H-pyridazine-5-carbonitrile

Systemtic Name: 3-[(E)-2-[5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]ethenyl]-4-methyl-6-oxidanylidene-1H-pyridazine-5-carbonitrile Openeye Name: 3-[(E)-2-[5-chloro-3-methyl-1-(p-tolylmethyl)pyrazol-4-yl]vinyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile CAS Name: 3-[(E)-2-[5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-4-pyrazolyl]ethenyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile IUPAC Name: 3-[(E)-2-[5-chloro-3-methyl-1-[(4-methylphenyl)methyl]pyrazol-4-yl]ethenyl]-4-methyl-6-oxo-1H-pyridazine-5-carbonitrile Traditional Name: 3-[(E)-2-[5-chloro-3-methyl-1-(4-methylbenzyl)pyrazol-4-yl]vinyl]-6-keto-4-methyl-1H-pyridazine-5-carbonitrile Formula: C20H18ClN5O MolecularWeight: 379.84282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C=CC3=NNC(=O)C(=C3C)C#N)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)/C=C/C3=NNC(=O)C(=C3C)C#N)Cl

InChI

InChI=1S/C20H18ClN5O/c1-12-4-6-15(7-5-12)11-26-19(21)16(14(3)25-26)8-9-18-13(2)17(10-22)20(27)24-23-18/h4-9H,11H2,1-3H3,(H,24,27)/b9-8+