4-[3-(3,4-dimethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(2-methylsulfanylphenyl)butanamide

Systemtic Name: 4-[3-(3,4-dimethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]-N-(2-methylsulfanylphenyl)butanamide Openeye Name: 4-[3-(3,4-dimethoxyphenyl)-6-oxo-pyridazin-1-yl]-N-(2-methylsulfanylphenyl)butanamide CAS Name: 4-[3-(3,4-dimethoxyphenyl)-6-oxo-1-pyridazinyl]-N-[2-(methylthio)phenyl]butanamide IUPAC Name: 4-[3-(3,4-dimethoxyphenyl)-6-oxopyridazin-1-yl]-N-(2-methylsulfanylphenyl)butanamide Traditional Name: 4-[3-(3,4-dimethoxyphenyl)-6-keto-pyridazin-1-yl]-N-[2-(methylthio)phenyl]butyramide Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)NC3=CC=CC=C3SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)CCCC(=O)NC3=CC=CC=C3SC)OC

InChI

InChI=1S/C23H25N3O4S/c1-29-19-12-10-16(15-20(19)30-2)17-11-13-23(28)26(25-17)14-6-9-22(27)24-18-7-4-5-8-21(18)31-3/h4-5,7-8,10-13,15H,6,9,14H2,1-3H3,(H,24,27)