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

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-oxidanylidene-1-(phenylmethyl)pyridazine-3-carboxamide Openeye Name: 1-benzyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-oxo-pyridazine-3-carboxamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-oxo-1-(phenylmethyl)-3-pyridazinecarboxamide IUPAC Name: 1-benzyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-oxopyridazine-3-carboxamide Traditional Name: 1-benzyl-6-keto-N-(6-mesyl-1,3-benzothiazol-2-yl)pyridazine-3-carboxamide Formula: C20H16N4O4S2 MolecularWeight: 440.49544

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=NN(C(=O)C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C20H16N4O4S2/c1-30(27,28)14-7-8-15-17(11-14)29-20(21-15)22-19(26)16-9-10-18(25)24(23-16)12-13-5-3-2-4-6-13/h2-11H,12H2,1H3,(H,21,22,26)