N-[2-[3-(4-ethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-2-methyl-1,3-benzothiazole-6-sulfonamide

Systemtic Name: N-[2-[3-(4-ethoxyphenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-2-methyl-1,3-benzothiazole-6-sulfonamide Openeye Name: N-[2-[3-(4-ethoxyphenyl)-6-oxo-pyridazin-1-yl]ethyl]-2-methyl-1,3-benzothiazole-6-sulfonamide CAS Name: N-[2-[3-(4-ethoxyphenyl)-6-oxo-1-pyridazinyl]ethyl]-2-methyl-1,3-benzothiazole-6-sulfonamide IUPAC Name: N-[2-[3-(4-ethoxyphenyl)-6-oxopyridazin-1-yl]ethyl]-2-methyl-1,3-benzothiazole-6-sulfonamide Traditional Name: N-[2-(6-keto-3-p-phenetyl-pyridazin-1-yl)ethyl]-2-methyl-1,3-benzothiazole-6-sulfonamide Formula: C22H22N4O4S2 MolecularWeight: 470.56448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCNS(=O)(=O)C3=CC4=C(C=C3)N=C(S4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CCNS(=O)(=O)C3=CC4=C(C=C3)N=C(S4)C

InChI

InChI=1S/C22H22N4O4S2/c1-3-30-17-6-4-16(5-7-17)19-10-11-22(27)26(25-19)13-12-23-32(28,29)18-8-9-20-21(14-18)31-15(2)24-20/h4-11,14,23H,3,12-13H2,1-2H3