5-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-7-[(4-oxidanylpyrrolidin-3-yl)amino]-3H-[1,3]thiazolo[4,5-d]pyrimidin-2-one

Systemtic Name: 5-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-7-[(4-oxidanylpyrrolidin-3-yl)amino]-3H-[1,3]thiazolo[4,5-d]pyrimidin-2-one Openeye Name: 5-[(2,3-difluorophenyl)methylsulfanyl]-7-[(4-hydroxypyrrolidin-3-yl)amino]-3H-thiazolo[4,5-d]pyrimidin-2-one CAS Name: 5-[(2,3-difluorophenyl)methylthio]-7-[(4-hydroxy-3-pyrrolidinyl)amino]-3H-thiazolo[4,5-d]pyrimidin-2-one IUPAC Name: 5-[(2,3-difluorophenyl)methylsulfanyl]-7-[(4-hydroxypyrrolidin-3-yl)amino]-3H-[1,3]thiazolo[4,5-d]pyrimidin-2-one Traditional Name: 5-[(2,3-difluorobenzyl)thio]-7-[(4-hydroxypyrrolidin-3-yl)amino]-3H-thiazolo[4,5-d]pyrimidin-2-one Formula: C16H15F2N5O2S2 MolecularWeight: 411.449406

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CN1)O)NC2=NC(=NC3=C2SC(=O)N3)SCC4=C(C(=CC=C4)F)F

Isomeric SMILES

C1C(C(CN1)O)NC2=NC(=NC3=C2SC(=O)N3)SCC4=C(C(=CC=C4)F)F

InChI

InChI=1S/C16H15F2N5O2S2/c17-8-3-1-2-7(11(8)18)6-26-15-21-13(20-9-4-19-5-10(9)24)12-14(22-15)23-16(25)27-12/h1-3,9-10,19,24H,4-6H2,(H2,20,21,22,23,25)