2,4-bis[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]pteridin-7-amine

Systemtic Name: 2,4-bis[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]pteridin-7-amine Openeye Name: 2,4-bis[(2,3-difluorophenyl)methylsulfanyl]pteridin-7-amine CAS Name: 2,4-bis[(2,3-difluorophenyl)methylthio]-7-pteridinamine IUPAC Name: 2,4-bis[(2,3-difluorophenyl)methylsulfanyl]pteridin-7-amine Traditional Name: [2,4-bis[(2,3-difluorobenzyl)thio]pteridin-7-yl]amine Formula: C20H13F4N5S2 MolecularWeight: 463.474333

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)F)CSC2=NC(=NC3=NC(=CN=C32)N)SCC4=C(C(=CC=C4)F)F

Isomeric SMILES

C1=CC(=C(C(=C1)F)F)CSC2=NC(=NC3=NC(=CN=C32)N)SCC4=C(C(=CC=C4)F)F

InChI

InChI=1S/C20H13F4N5S2/c21-12-5-1-3-10(15(12)23)8-30-19-17-18(27-14(25)7-26-17)28-20(29-19)31-9-11-4-2-6-13(22)16(11)24/h1-7H,8-9H2,(H2,25,27,28,29)