1-(4-chloranyl-3-fluoranyl-phenyl)-3-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)amino]thiourea

Systemtic Name: 1-(4-chloranyl-3-fluoranyl-phenyl)-3-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)amino]thiourea Openeye Name: 1-(4-chloro-3-fluoro-phenyl)-3-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)amino]thiourea CAS Name: 1-(4-chloro-3-fluorophenyl)-3-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)amino]thiourea IUPAC Name: 1-(4-chloro-3-fluorophenyl)-3-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)amino]thiourea Traditional Name: 1-(4-chloro-3-fluoro-phenyl)-3-[(4-keto-6-methyl-1H-pyrimidin-2-yl)amino]thiourea Formula: C12H11ClFN5OS MolecularWeight: 327.765043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)NNC(=S)NC2=CC(=C(C=C2)Cl)F

Isomeric SMILES

CC1=CC(=O)N=C(N1)NNC(=S)NC2=CC(=C(C=C2)Cl)F

InChI

InChI=1S/C12H11ClFN5OS/c1-6-4-10(20)17-11(15-6)18-19-12(21)16-7-2-3-8(13)9(14)5-7/h2-5H,1H3,(H2,16,19,21)(H2,15,17,18,20)