5-bromanyl-4-[(3,4-dimethoxyphenyl)methylamino]-3-[2-(2,4-dimethylphenyl)sulfinylethoxy]-1H-pyridazin-6-one

Systemtic Name: 5-bromanyl-4-[(3,4-dimethoxyphenyl)methylamino]-3-[2-(2,4-dimethylphenyl)sulfinylethoxy]-1H-pyridazin-6-one Openeye Name: 5-bromo-4-[(3,4-dimethoxyphenyl)methylamino]-3-[2-(2,4-dimethylphenyl)sulfinylethoxy]-1H-pyridazin-6-one CAS Name: 5-bromo-4-[(3,4-dimethoxyphenyl)methylamino]-3-[2-(2,4-dimethylphenyl)sulfinylethoxy]-1H-pyridazin-6-one IUPAC Name: 5-bromo-4-[(3,4-dimethoxyphenyl)methylamino]-3-[2-(2,4-dimethylphenyl)sulfinylethoxy]-1H-pyridazin-6-one Traditional Name: 5-bromo-3-[2-(2,4-dimethylphenyl)sulfinylethoxy]-4-(veratrylamino)-1H-pyridazin-6-one Formula: C23H26BrN3O5S MolecularWeight: 536.43864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)CCOC2=NNC(=O)C(=C2NCC3=CC(=C(C=C3)OC)OC)Br)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)CCOC2=NNC(=O)C(=C2NCC3=CC(=C(C=C3)OC)OC)Br)C

InChI

InChI=1S/C23H26BrN3O5S/c1-14-5-8-19(15(2)11-14)33(29)10-9-32-23-21(20(24)22(28)26-27-23)25-13-16-6-7-17(30-3)18(12-16)31-4/h5-8,11-12H,9-10,13H2,1-4H3,(H2,25,26,28)