1-(4-ethoxyphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: 1-(4-ethoxyphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: 1-(4-ethoxyphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-oxo-pyridazine-3-carboxamide CAS Name: 1-(4-ethoxyphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-oxo-3-pyridazinecarboxamide IUPAC Name: 1-(4-ethoxyphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-oxopyridazine-3-carboxamide Traditional Name: 4-keto-N-(6-mesyl-1,3-benzothiazol-2-yl)-1-p-phenetyl-pyridazine-3-carboxamide Formula: C21H18N4O5S2 MolecularWeight: 470.52142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C=CC(=O)C(=N2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C=CC(=O)C(=N2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C21H18N4O5S2/c1-3-30-14-6-4-13(5-7-14)25-11-10-17(26)19(24-25)20(27)23-21-22-16-9-8-15(32(2,28)29)12-18(16)31-21/h4-12H,3H2,1-2H3,(H,22,23,27)