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

Systemtic Name: 1-(4-methylphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-oxo-1-(p-tolyl)pyridazine-3-carboxamide CAS Name: 1-(4-methylphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-oxo-3-pyridazinecarboxamide IUPAC Name: 1-(4-methylphenyl)-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-tolyl)pyridazine-3-carboxamide Formula: C20H16N4O4S2 MolecularWeight: 440.49544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=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

CC1=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/C20H16N4O4S2/c1-12-3-5-13(6-4-12)24-10-9-16(25)18(23-24)19(26)22-20-21-15-8-7-14(30(2,27)28)11-17(15)29-20/h3-11H,1-2H3,(H,21,22,26)