(2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-1,3-benzoxazol-5-yl)-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-1,3-benzoxazol-5-yl)-4-methylsulfanyl-butanamide Openeye Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-1,3-benzoxazol-5-yl)-4-methylsulfanyl-butanamide CAS Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-1,3-benzoxazol-5-yl)-4-(methylthio)butanamide IUPAC Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-1,3-benzoxazol-5-yl)-4-methylsulfanylbutanamide Traditional Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(2-methyl-1,3-benzoxazol-5-yl)-4-(methylthio)butyramide Formula: C19H20ClN3O4S2 MolecularWeight: 453.9628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(O1)C=CC(=C2)NC(=O)C(CCSC)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NC2=C(O1)C=CC(=C2)NC(=O)[C@H](CCSC)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H20ClN3O4S2/c1-12-21-17-11-14(5-8-18(17)27-12)22-19(24)16(9-10-28-2)23-29(25,26)15-6-3-13(20)4-7-15/h3-8,11,16,23H,9-10H2,1-2H3,(H,22,24)/t16-/m0/s1