(2S)-2-[6-(dimethylsulfamoyl)benzotriazol-1-yl]oxy-N-(3-fluoranyl-4-methyl-phenyl)propanamide

Systemtic Name: (2S)-2-[6-(dimethylsulfamoyl)benzotriazol-1-yl]oxy-N-(3-fluoranyl-4-methyl-phenyl)propanamide Openeye Name: (2S)-2-[6-(dimethylsulfamoyl)benzotriazol-1-yl]oxy-N-(3-fluoro-4-methyl-phenyl)propanamide CAS Name: (2S)-2-[[6-(dimethylsulfamoyl)-1-benzotriazolyl]oxy]-N-(3-fluoro-4-methylphenyl)propanamide IUPAC Name: (2S)-2-[6-(dimethylsulfamoyl)benzotriazol-1-yl]oxy-N-(3-fluoro-4-methylphenyl)propanamide Traditional Name: (2S)-2-[6-(dimethylsulfamoyl)benzotriazol-1-yl]oxy-N-(3-fluoro-4-methyl-phenyl)propionamide Formula: C18H20FN5O4S MolecularWeight: 421.445903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)ON2C3=C(C=CC(=C3)S(=O)(=O)N(C)C)N=N2)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)[C@H](C)ON2C3=C(C=CC(=C3)S(=O)(=O)N(C)C)N=N2)F

InChI

InChI=1S/C18H20FN5O4S/c1-11-5-6-13(9-15(11)19)20-18(25)12(2)28-24-17-10-14(29(26,27)23(3)4)7-8-16(17)21-22-24/h5-10,12H,1-4H3,(H,20,25)/t12-/m0/s1