N-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-3-(trifluoromethyl)benzenecarbothioamide

Systemtic Name: N-[1,4-bis(oxidanylidene)-2,3-dihydrophthalazin-5-yl]-3-(trifluoromethyl)benzenecarbothioamide Openeye Name: N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-3-(trifluoromethyl)benzenecarbothioamide CAS Name: N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-3-(trifluoromethyl)benzenecarbothioamide IUPAC Name: N-(1,4-dioxo-2,3-dihydrophthalazin-5-yl)-3-(trifluoromethyl)benzenecarbothioamide Traditional Name: N-(1,4-diketo-2,3-dihydrophthalazin-5-yl)-3-(trifluoromethyl)thiobenzamide Formula: C16H10F3N3O2S MolecularWeight: 365.32971

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C(=S)NC2=CC=CC3=C2C(=O)NNC3=O

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C(=S)NC2=CC=CC3=C2C(=O)NNC3=O

InChI

InChI=1S/C16H10F3N3O2S/c17-16(18,19)9-4-1-3-8(7-9)15(25)20-11-6-2-5-10-12(11)14(24)22-21-13(10)23/h1-7H,(H,20,25)(H,21,23)(H,22,24)