2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4,5-diamine

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4,5-diamine Openeye Name: 2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4,5-diamine CAS Name: 2-[(4-fluorophenyl)methylthio]pyrimidine-4,5-diamine IUPAC Name: 2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4,5-diamine Traditional Name: [4-amino-2-[(4-fluorobenzyl)thio]pyrimidin-5-yl]amine Formula: C11H11FN4S MolecularWeight: 250.295243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NC=C(C(=N2)N)N)F

Isomeric SMILES

C1=CC(=CC=C1CSC2=NC=C(C(=N2)N)N)F

InChI

InChI=1S/C11H11FN4S/c12-8-3-1-7(2-4-8)6-17-11-15-5-9(13)10(14)16-11/h1-5H,6,13H2,(H2,14,15,16)