(2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[2-[methyl-[2-oxidanylidene-2-[[2-(trifluoromethyl)phenyl]amino]ethyl]amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide

Systemtic Name: (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[2-[methyl-[2-oxidanylidene-2-[[2-(trifluoromethyl)phenyl]amino]ethyl]amino]-2-oxidanylidene-ethyl]sulfanyl-propanamide Openeye Name: (2S)-N-(5-methylisoxazol-3-yl)-2-[2-[methyl-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]amino]-2-oxo-ethyl]sulfanyl-propanamide CAS Name: (2S)-N-(5-methyl-3-isoxazolyl)-2-[[2-[methyl-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]amino]-2-oxoethyl]thio]propanamide IUPAC Name: (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[2-[methyl-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]amino]-2-oxoethyl]sulfanylpropanamide Traditional Name: (2S)-2-[[2-keto-2-[[2-keto-2-[2-(trifluoromethyl)anilino]ethyl]-methyl-amino]ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C19H21F3N4O4S MolecularWeight: 458.45465

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)N(C)CC(=O)NC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

CC1=CC(=NO1)NC(=O)[C@H](C)SCC(=O)N(C)CC(=O)NC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C19H21F3N4O4S/c1-11-8-15(25-30-11)24-18(29)12(2)31-10-17(28)26(3)9-16(27)23-14-7-5-4-6-13(14)19(20,21)22/h4-8,12H,9-10H2,1-3H3,(H,23,27)(H,24,25,29)/t12-/m0/s1