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

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]thiourea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-[(3-methyl-4-oxo-phthalazine-1-carbonyl)amino]thiourea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]thiourea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-[(3-methyl-4-oxophthalazine-1-carbonyl)amino]thiourea Traditional Name: 1-(4-fluorobenzyl)-3-[(4-keto-3-methyl-phthalazine-1-carbonyl)amino]thiourea Formula: C18H16FN5O2S MolecularWeight: 385.415343

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=S)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C18H16FN5O2S/c1-24-17(26)14-5-3-2-4-13(14)15(23-24)16(25)21-22-18(27)20-10-11-6-8-12(19)9-7-11/h2-9H,10H2,1H3,(H,21,25)(H2,20,22,27)