3-[[4-[bis(fluoranyl)methyl]-6-methyl-pyrimidin-2-yl]sulfanylmethyl]-4-methoxy-benzaldehyde

Systemtic Name: 3-[[4-[bis(fluoranyl)methyl]-6-methyl-pyrimidin-2-yl]sulfanylmethyl]-4-methoxy-benzaldehyde Openeye Name: 3-[[4-(difluoromethyl)-6-methyl-pyrimidin-2-yl]sulfanylmethyl]-4-methoxy-benzaldehyde CAS Name: 3-[[[4-(difluoromethyl)-6-methyl-2-pyrimidinyl]thio]methyl]-4-methoxybenzaldehyde IUPAC Name: 3-[[4-(difluoromethyl)-6-methylpyrimidin-2-yl]sulfanylmethyl]-4-methoxybenzaldehyde Traditional Name: 3-[[[4-(difluoromethyl)-6-methyl-pyrimidin-2-yl]thio]methyl]-4-methoxy-benzaldehyde Formula: C15H14F2N2O2S MolecularWeight: 324.345666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=C(C=CC(=C2)C=O)OC)C(F)F

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=C(C=CC(=C2)C=O)OC)C(F)F

InChI

InChI=1S/C15H14F2N2O2S/c1-9-5-12(14(16)17)19-15(18-9)22-8-11-6-10(7-20)3-4-13(11)21-2/h3-7,14H,8H2,1-2H3