2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-5-nitroso-pyrimidine-4,6-diamine

Systemtic Name: 2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-5-nitroso-pyrimidine-4,6-diamine Openeye Name: 2-[(2,3-difluorophenyl)methylsulfanyl]-5-nitroso-pyrimidine-4,6-diamine CAS Name: 2-[(2,3-difluorophenyl)methylthio]-5-nitrosopyrimidine-4,6-diamine IUPAC Name: 2-[(2,3-difluorophenyl)methylsulfanyl]-5-nitrosopyrimidine-4,6-diamine Traditional Name: [6-amino-2-[(2,3-difluorobenzyl)thio]-5-nitroso-pyrimidin-4-yl]amine Formula: C11H9F2N5OS MolecularWeight: 297.283866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)F)CSC2=NC(=C(C(=N2)N)N=O)N

Isomeric SMILES

C1=CC(=C(C(=C1)F)F)CSC2=NC(=C(C(=N2)N)N=O)N

InChI

InChI=1S/C11H9F2N5OS/c12-6-3-1-2-5(7(6)13)4-20-11-16-9(14)8(18-19)10(15)17-11/h1-3H,4H2,(H4,14,15,16,17)