4-[(2-fluoranyl-4-methylsulfanyl-phenyl)amino]-1,5-dimethyl-6-oxidanylidene-N-(3-oxidanylpropyl)pyridazine-3-carboxamide

Systemtic Name: 4-[(2-fluoranyl-4-methylsulfanyl-phenyl)amino]-1,5-dimethyl-6-oxidanylidene-N-(3-oxidanylpropyl)pyridazine-3-carboxamide Openeye Name: 4-(2-fluoro-4-methylsulfanyl-anilino)-N-(3-hydroxypropyl)-1,5-dimethyl-6-oxo-pyridazine-3-carboxamide CAS Name: 4-[2-fluoro-4-(methylthio)anilino]-N-(3-hydroxypropyl)-1,5-dimethyl-6-oxo-3-pyridazinecarboxamide IUPAC Name: 4-(2-fluoro-4-methylsulfanylanilino)-N-(3-hydroxypropyl)-1,5-dimethyl-6-oxopyridazine-3-carboxamide Traditional Name: 4-[2-fluoro-4-(methylthio)anilino]-N-(3-hydroxypropyl)-6-keto-1,5-dimethyl-pyridazine-3-carboxamide Formula: C17H21FN4O3S MolecularWeight: 380.437043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN(C1=O)C)C(=O)NCCCO)NC2=C(C=C(C=C2)SC)F

Isomeric SMILES

CC1=C(C(=NN(C1=O)C)C(=O)NCCCO)NC2=C(C=C(C=C2)SC)F

InChI

InChI=1S/C17H21FN4O3S/c1-10-14(20-13-6-5-11(26-3)9-12(13)18)15(21-22(2)17(10)25)16(24)19-7-4-8-23/h5-6,9,20,23H,4,7-8H2,1-3H3,(H,19,24)