1-(3-chloranyl-4-methyl-phenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide Openeye Name: 1-(3-chloro-4-methyl-phenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide CAS Name: 1-(3-chloro-4-methylphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide IUPAC Name: 1-(3-chloro-4-methylphenyl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide Traditional Name: 1-(3-chloro-4-methyl-phenyl)-6-keto-N-(6-mesyl-1,3-benzothiazol-2-yl)-4,5-dihydropyridazine-3-carboxamide Formula: C20H17ClN4O4S2 MolecularWeight: 476.95638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)CCC(=N2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)CCC(=N2)C(=O)NC3=NC4=C(S3)C=C(C=C4)S(=O)(=O)C)Cl

InChI

InChI=1S/C20H17ClN4O4S2/c1-11-3-4-12(9-14(11)21)25-18(26)8-7-16(24-25)19(27)23-20-22-15-6-5-13(31(2,28)29)10-17(15)30-20/h3-6,9-10H,7-8H2,1-2H3,(H,22,23,27)