6-azanyl-2-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propylsulfanyl]-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propylsulfanyl]-1H-pyrimidin-4-one CAS Name: 6-amino-2-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propylthio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[3-[2-(4-fluorophenyl)-1,3-dioxolan-2-yl]propylthio]-1H-pyrimidin-4-one Formula: C16H18FN3O3S MolecularWeight: 351.395823

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(O1)(CCCSC2=NC(=O)C=C(N2)N)C3=CC=C(C=C3)F

Isomeric SMILES

C1COC(O1)(CCCSC2=NC(=O)C=C(N2)N)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H18FN3O3S/c17-12-4-2-11(3-5-12)16(22-7-8-23-16)6-1-9-24-15-19-13(18)10-14(21)20-15/h2-5,10H,1,6-9H2,(H3,18,19,20,21)