1-[2-(1-oxidanylidenephthalazin-2-yl)ethanoylamino]-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[2-(1-oxidanylidenephthalazin-2-yl)ethanoylamino]-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[[2-(1-oxophthalazin-2-yl)acetyl]amino]-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[[1-oxo-2-(1-oxo-2-phthalazinyl)ethyl]amino]-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[[2-(1-oxophthalazin-2-yl)acetyl]amino]-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[[2-(1-ketophthalazin-2-yl)acetyl]amino]-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C18H14F3N5O2S MolecularWeight: 421.39627

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN(C2=O)CC(=O)NNC(=S)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=NN(C2=O)CC(=O)NNC(=S)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C18H14F3N5O2S/c19-18(20,21)13-7-3-4-8-14(13)23-17(29)25-24-15(27)10-26-16(28)12-6-2-1-5-11(12)9-22-26/h1-9H,10H2,(H,24,27)(H2,23,25,29)