6-(4-chlorophenyl)sulfanyl-5-methyl-2-[4-[(2-methylpropan-2-yl)oxy]phenyl]-3-oxidanylidene-pyridazine-4-carbonitrile

Systemtic Name: 6-(4-chlorophenyl)sulfanyl-5-methyl-2-[4-[(2-methylpropan-2-yl)oxy]phenyl]-3-oxidanylidene-pyridazine-4-carbonitrile Openeye Name: 2-(4-tert-butoxyphenyl)-6-(4-chlorophenyl)sulfanyl-5-methyl-3-oxo-pyridazine-4-carbonitrile CAS Name: 6-[(4-chlorophenyl)thio]-5-methyl-2-[4-[(2-methylpropan-2-yl)oxy]phenyl]-3-oxo-4-pyridazinecarbonitrile IUPAC Name: 6-(4-chlorophenyl)sulfanyl-5-methyl-2-[4-[(2-methylpropan-2-yl)oxy]phenyl]-3-oxopyridazine-4-carbonitrile Traditional Name: 2-(4-tert-butoxyphenyl)-6-[(4-chlorophenyl)thio]-3-keto-5-methyl-pyridazine-4-carbonitrile Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1SC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC(C)(C)C)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1SC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC(C)(C)C)C#N

InChI

InChI=1S/C22H20ClN3O2S/c1-14-19(13-24)21(27)26(16-7-9-17(10-8-16)28-22(2,3)4)25-20(14)29-18-11-5-15(23)6-12-18/h5-12H,1-4H3