2-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: 2-[[6-(2,5-dimethoxyphenyl)-3-pyridazinyl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-benzyl-2-[[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]thio]acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=NN=C(C=C2)SCC(=O)NCC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=NN=C(C=C2)SCC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3S/c1-26-16-8-10-19(27-2)17(12-16)18-9-11-21(24-23-18)28-14-20(25)22-13-15-6-4-3-5-7-15/h3-12H,13-14H2,1-2H3,(H,22,25)