(2S)-N-(3-fluoranyl-4-methyl-phenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide

Systemtic Name: (2S)-N-(3-fluoranyl-4-methyl-phenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide Openeye Name: (2S)-N-(3-fluoro-4-methyl-phenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide CAS Name: (2S)-N-(3-fluoro-4-methylphenyl)-2-(4-thieno[2,3-d]pyrimidinylthio)propanamide IUPAC Name: (2S)-N-(3-fluoro-4-methylphenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanylpropanamide Traditional Name: (2S)-N-(3-fluoro-4-methyl-phenyl)-2-(thieno[2,3-d]pyrimidin-4-ylthio)propionamide Formula: C16H14FN3OS2 MolecularWeight: 347.430263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NC=NC3=C2C=CS3)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](C)SC2=NC=NC3=C2C=CS3)F

InChI

InChI=1S/C16H14FN3OS2/c1-9-3-4-11(7-13(9)17)20-14(21)10(2)23-16-12-5-6-22-15(12)18-8-19-16/h3-8,10H,1-2H3,(H,20,21)/t10-/m0/s1