(2R)-N-(3-chloranyl-4-fluoranyl-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(3-chloranyl-4-fluoranyl-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(3-chloro-4-fluoro-phenyl)-2-(1-methylimidazol-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(3-chloro-4-fluorophenyl)-2-[(1-methyl-2-imidazolyl)thio]propanamide IUPAC Name: (2R)-N-(3-chloro-4-fluorophenyl)-2-(1-methylimidazol-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(3-chloro-4-fluoro-phenyl)-2-[(1-methylimidazol-2-yl)thio]propionamide Formula: C13H13ClFN3OS MolecularWeight: 313.778223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)F)Cl)SC2=NC=CN2C

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=C(C=C1)F)Cl)SC2=NC=CN2C

InChI

InChI=1S/C13H13ClFN3OS/c1-8(20-13-16-5-6-18(13)2)12(19)17-9-3-4-11(15)10(14)7-9/h3-8H,1-2H3,(H,17,19)/t8-/m1/s1