(2S)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(2-phenylsulfanylethyl)propanamide

Systemtic Name: (2S)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(2-phenylsulfanylethyl)propanamide Openeye Name: (2S)-2-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]-N-(2-phenylsulfanylethyl)propanamide CAS Name: (2S)-2-[(3,5-dimethyl-4-isoxazolyl)sulfonylamino]-N-[2-(phenylthio)ethyl]propanamide IUPAC Name: (2S)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]-N-(2-phenylsulfanylethyl)propanamide Traditional Name: (2S)-2-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]-N-[2-(phenylthio)ethyl]propionamide Formula: C16H21N3O4S2 MolecularWeight: 383.48564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)NC(C)C(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N[C@@H](C)C(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C16H21N3O4S2/c1-11-15(13(3)23-18-11)25(21,22)19-12(2)16(20)17-9-10-24-14-7-5-4-6-8-14/h4-8,12,19H,9-10H2,1-3H3,(H,17,20)/t12-/m0/s1