N-(4-acetamido-3-chloranyl-phenyl)-1-[1,1-bis(oxidanylidene)thiolan-3-yl]-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide

Systemtic Name: N-(4-acetamido-3-chloranyl-phenyl)-1-[1,1-bis(oxidanylidene)thiolan-3-yl]-6-oxidanylidene-4,5-dihydropyridazine-3-carboxamide Openeye Name: N-(4-acetamido-3-chloro-phenyl)-1-(1,1-dioxothiolan-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide CAS Name: N-(4-acetamido-3-chlorophenyl)-1-(1,1-dioxo-3-thiolanyl)-6-oxo-4,5-dihydropyridazine-3-carboxamide IUPAC Name: N-(4-acetamido-3-chlorophenyl)-1-(1,1-dioxothiolan-3-yl)-6-oxo-4,5-dihydropyridazine-3-carboxamide Traditional Name: N-(4-acetamido-3-chloro-phenyl)-1-(1,1-diketothiolan-3-yl)-6-keto-4,5-dihydropyridazine-3-carboxamide Formula: C17H19ClN4O5S MolecularWeight: 426.87456

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)CC2)C3CCS(=O)(=O)C3)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)CC2)C3CCS(=O)(=O)C3)Cl

InChI

InChI=1S/C17H19ClN4O5S/c1-10(23)19-14-3-2-11(8-13(14)18)20-17(25)15-4-5-16(24)22(21-15)12-6-7-28(26,27)9-12/h2-3,8,12H,4-7,9H2,1H3,(H,19,23)(H,20,25)