4-[5-chloranyl-1-(3-chlorophenyl)-6-oxidanylidene-pyridazin-4-yl]-N-(2-cyano-4,5-dimethoxy-phenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[5-chloranyl-1-(3-chlorophenyl)-6-oxidanylidene-pyridazin-4-yl]-N-(2-cyano-4,5-dimethoxy-phenyl)piperazine-1-carbothioamide Openeye Name: 4-[5-chloro-1-(3-chlorophenyl)-6-oxo-pyridazin-4-yl]-N-(2-cyano-4,5-dimethoxy-phenyl)piperazine-1-carbothioamide CAS Name: 4-[5-chloro-1-(3-chlorophenyl)-6-oxo-4-pyridazinyl]-N-(2-cyano-4,5-dimethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[5-chloro-1-(3-chlorophenyl)-6-oxopyridazin-4-yl]-N-(2-cyano-4,5-dimethoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-[5-chloro-1-(3-chlorophenyl)-6-keto-pyridazin-4-yl]-N-(2-cyano-4,5-dimethoxy-phenyl)piperazine-1-carbothioamide Formula: C24H22Cl2N6O3S MolecularWeight: 545.44088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C#N)NC(=S)N2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC(=CC=C4)Cl)Cl)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C#N)NC(=S)N2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC(=CC=C4)Cl)Cl)OC

InChI

InChI=1S/C24H22Cl2N6O3S/c1-34-20-10-15(13-27)18(12-21(20)35-2)29-24(36)31-8-6-30(7-9-31)19-14-28-32(23(33)22(19)26)17-5-3-4-16(25)11-17/h3-5,10-12,14H,6-9H2,1-2H3,(H,29,36)