N-(7-fluoranyl-3-oxidanylidene-4-prop-2-ynyl-4H-1,2-benzoxazin-6-yl)-4,5-dihydro-3H-pyridazine-2-carbothioamide

Systemtic Name: N-(7-fluoranyl-3-oxidanylidene-4-prop-2-ynyl-4H-1,2-benzoxazin-6-yl)-4,5-dihydro-3H-pyridazine-2-carbothioamide Openeye Name: N-(7-fluoro-3-oxo-4-prop-2-ynyl-4H-1,2-benzoxazin-6-yl)-4,5-dihydro-3H-pyridazine-2-carbothioamide CAS Name: N-(7-fluoro-3-oxo-4-prop-2-ynyl-4H-1,2-benzoxazin-6-yl)-4,5-dihydro-3H-pyridazine-2-carbothioamide IUPAC Name: N-(7-fluoro-3-oxo-4-prop-2-ynyl-4H-1,2-benzoxazin-6-yl)-4,5-dihydro-3H-pyridazine-2-carbothioamide Traditional Name: N-(7-fluoro-3-keto-4-propargyl-4H-1,2-benzoxazin-6-yl)-4,5-dihydro-3H-pyridazine-2-carbothioamide Formula: C16H15FN4O2S MolecularWeight: 346.379303

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC1C2=CC(=C(C=C2ONC1=O)F)NC(=S)N3CCCC=N3

Isomeric SMILES

C#CCC1C2=CC(=C(C=C2ONC1=O)F)NC(=S)N3CCCC=N3

InChI

InChI=1S/C16H15FN4O2S/c1-2-5-10-11-8-13(12(17)9-14(11)23-20-15(10)22)19-16(24)21-7-4-3-6-18-21/h1,6,8-10H,3-5,7H2,(H,19,24)(H,20,22)