(2R)-2-(2,5-dimethylphenyl)sulfanyl-N-(4-fluoranyl-3-nitro-phenyl)propanamide

Systemtic Name: (2R)-2-(2,5-dimethylphenyl)sulfanyl-N-(4-fluoranyl-3-nitro-phenyl)propanamide Openeye Name: (2R)-2-(2,5-dimethylphenyl)sulfanyl-N-(4-fluoro-3-nitro-phenyl)propanamide CAS Name: (2R)-2-[(2,5-dimethylphenyl)thio]-N-(4-fluoro-3-nitrophenyl)propanamide IUPAC Name: (2R)-2-(2,5-dimethylphenyl)sulfanyl-N-(4-fluoro-3-nitrophenyl)propanamide Traditional Name: (2R)-2-[(2,5-dimethylphenyl)thio]-N-(4-fluoro-3-nitro-phenyl)propionamide Formula: C17H17FN2O3S MolecularWeight: 348.391883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC(C)C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)S[C@H](C)C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C17H17FN2O3S/c1-10-4-5-11(2)16(8-10)24-12(3)17(21)19-13-6-7-14(18)15(9-13)20(22)23/h4-9,12H,1-3H3,(H,19,21)/t12-/m1/s1