2-[[(2S)-1-[3,4-bis(fluoranyl)phenyl]-1-oxidanylidene-propan-2-yl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[(2S)-1-[3,4-bis(fluoranyl)phenyl]-1-oxidanylidene-propan-2-yl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[[(1S)-2-(3,4-difluorophenyl)-1-methyl-2-oxo-ethyl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[[(2S)-1-(3,4-difluorophenyl)-1-oxopropan-2-yl]thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[[(2S)-1-(3,4-difluorophenyl)-1-oxopropan-2-yl]sulfanylmethyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[[(1S)-2-(3,4-difluorophenyl)-2-keto-1-methyl-ethyl]thio]methyl]-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H16F2N2O2S2 MolecularWeight: 394.458646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC(C)C(=O)C3=CC(=C(C=C3)F)F)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CS[C@@H](C)C(=O)C3=CC(=C(C=C3)F)F)C

InChI

InChI=1S/C18H16F2N2O2S2/c1-8-9(2)26-18-15(8)17(24)21-14(22-18)7-25-10(3)16(23)11-4-5-12(19)13(20)6-11/h4-6,10H,7H2,1-3H3,(H,21,22,24)/t10-/m0/s1