[3-(2-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]methyl N,N'-dimethylcarbamimidothioate

Systemtic Name: [3-(2-fluorophenyl)-4-oxidanylidene-quinazolin-2-yl]methyl N,N'-dimethylcarbamimidothioate Openeye Name: 2-[[3-(2-fluorophenyl)-4-oxo-quinazolin-2-yl]methyl]-1,3-dimethyl-isothiourea CAS Name: N,N'-dimethylcarbamimidothioic acid [3-(2-fluorophenyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(2-fluorophenyl)-4-oxoquinazolin-2-yl]methyl N,N'-dimethylcarbamimidothioate Traditional Name: 2-[[3-(2-fluorophenyl)-4-keto-quinazolin-2-yl]methyl]-1,3-dimethyl-isothiourea Formula: C18H17FN4OS MolecularWeight: 356.417183

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=NC)SCC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3F

Isomeric SMILES

CNC(=NC)SCC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3F

InChI

InChI=1S/C18H17FN4OS/c1-20-18(21-2)25-11-16-22-14-9-5-3-7-12(14)17(24)23(16)15-10-6-4-8-13(15)19/h3-10H,11H2,1-2H3,(H,20,21)