N-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-1,5-bis(oxidanylidene)-1,4-thiazepane-3-carboxamide

Systemtic Name: N-[4-(4-methyl-6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-1,5-bis(oxidanylidene)-1,4-thiazepane-3-carboxamide Openeye Name: N-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-1,5-dioxo-1,4-thiazepane-3-carboxamide CAS Name: N-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-1,5-dioxo-1,4-thiazepane-3-carboxamide IUPAC Name: N-[4-(4-methyl-6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-1,5-dioxo-1,4-thiazepane-3-carboxamide Traditional Name: 1,5-diketo-N-[4-(6-keto-4-methyl-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-1,4-thiazepane-3-carboxamide Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NN=C1C2=CC=C(C=C2)NC(=O)C3CS(=O)CCC(=O)N3

Isomeric SMILES

CC1CC(=O)NN=C1C2=CC=C(C=C2)NC(=O)C3CS(=O)CCC(=O)N3

InChI

InChI=1S/C17H20N4O4S/c1-10-8-15(23)20-21-16(10)11-2-4-12(5-3-11)18-17(24)13-9-26(25)7-6-14(22)19-13/h2-5,10,13H,6-9H2,1H3,(H,18,24)(H,19,22)(H,20,23)