4-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-6-methyl-2-propan-2-yl-pyrimidine

Systemtic Name: 4-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-6-methyl-2-propan-2-yl-pyrimidine Openeye Name: 4-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-2-isopropyl-6-methyl-pyrimidine CAS Name: 4-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-6-methyl-2-propan-2-ylpyrimidine IUPAC Name: 4-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-6-methyl-2-propan-2-ylpyrimidine Traditional Name: 4-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-2-isopropyl-6-methyl-pyrimidine Formula: C17H19FN2O2S MolecularWeight: 334.408363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)SCC2=C3C(=CC(=C2)F)COCO3

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)SCC2=C3C(=CC(=C2)F)COCO3

InChI

InChI=1S/C17H19FN2O2S/c1-10(2)17-19-11(3)4-15(20-17)23-8-13-6-14(18)5-12-7-21-9-22-16(12)13/h4-6,10H,7-9H2,1-3H3