1-phthalazin-5-yl-3-[[4-(trifluoromethyl)phenyl]methyl]urea hydrochloride

Systemtic Name: 1-phthalazin-5-yl-3-[[4-(trifluoromethyl)phenyl]methyl]urea hydrochloride Openeye Name: 1-phthalazin-5-yl-3-[[4-(trifluoromethyl)phenyl]methyl]urea hydrochloride CAS Name: 1-(5-phthalazinyl)-3-[[4-(trifluoromethyl)phenyl]methyl]urea hydrochloride IUPAC Name: 1-phthalazin-5-yl-3-[[4-(trifluoromethyl)phenyl]methyl]urea hydrochloride Traditional Name: 1-phthalazin-5-yl-3-[4-(trifluoromethyl)benzyl]urea hydrochloride Formula: C17H14ClF3N4O MolecularWeight: 382.76747

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CN=NC=C2C(=C1)NC(=O)NCC3=CC=C(C=C3)C(F)(F)F.Cl

Isomeric SMILES

C1=CC2=CN=NC=C2C(=C1)NC(=O)NCC3=CC=C(C=C3)C(F)(F)F.Cl

InChI

InChI=1S/C17H13F3N4O.ClH/c18-17(19,20)13-6-4-11(5-7-13)8-21-16(25)24-15-3-1-2-12-9-22-23-10-14(12)15;/h1-7,9-10H,8H2,(H2,21,24,25);1H