1-(2-fluorophenyl)-3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]thiourea

Systemtic Name: 1-(2-fluorophenyl)-3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]thiourea Openeye Name: 1-(2-fluorophenyl)-3-[(4-oxo-3H-phthalazine-1-carbonyl)amino]thiourea CAS Name: 1-(2-fluorophenyl)-3-[[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]amino]thiourea IUPAC Name: 1-(2-fluorophenyl)-3-[(4-oxo-3H-phthalazine-1-carbonyl)amino]thiourea Traditional Name: 1-(2-fluorophenyl)-3-[(4-keto-3H-phthalazine-1-carbonyl)amino]thiourea Formula: C16H12FN5O2S MolecularWeight: 357.362183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NNC(=S)NC3=CC=CC=C3F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NNC(=S)NC3=CC=CC=C3F

InChI

InChI=1S/C16H12FN5O2S/c17-11-7-3-4-8-12(11)18-16(25)22-21-15(24)13-9-5-1-2-6-10(9)14(23)20-19-13/h1-8H,(H,20,23)(H,21,24)(H2,18,22,25)