4-[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]-2,2,3-trimethyl-3-oxidanyl-4H-chromene-6-carbothioamide

Systemtic Name: 4-[3,6-bis(oxidanylidene)-1H-pyridazin-2-yl]-2,2,3-trimethyl-3-oxidanyl-4H-chromene-6-carbothioamide Openeye Name: 4-(3,6-dioxo-1H-pyridazin-2-yl)-3-hydroxy-2,2,3-trimethyl-chromane-6-carbothioamide CAS Name: 4-(3,6-dioxo-1H-pyridazin-2-yl)-3-hydroxy-2,2,3-trimethyl-3,4-dihydro-2H-1-benzopyran-6-carbothioamide IUPAC Name: 4-(3,6-dioxo-1H-pyridazin-2-yl)-3-hydroxy-2,2,3-trimethyl-4H-chromene-6-carbothioamide Traditional Name: 4-(3,6-diketo-1H-pyridazin-2-yl)-3-hydroxy-2,2,3-trimethyl-chroman-6-carbothioamide Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C(=S)N)N3C(=O)C=CC(=O)N3)(C)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C(=S)N)N3C(=O)C=CC(=O)N3)(C)O)C

InChI

InChI=1S/C17H19N3O4S/c1-16(2)17(3,23)14(20-13(22)7-6-12(21)19-20)10-8-9(15(18)25)4-5-11(10)24-16/h4-8,14,23H,1-3H3,(H2,18,25)(H,19,21)