propan-2-yl 3-[[4-[bis(fluoranyl)methylsulfanyl]phenyl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: propan-2-yl 3-[[4-[bis(fluoranyl)methylsulfanyl]phenyl]carbonylamino]-3-phenyl-propanoate Openeye Name: isopropyl 3-[[4-(difluoromethylsulfanyl)benzoyl]amino]-3-phenyl-propanoate CAS Name: 3-[[[4-(difluoromethylthio)phenyl]-oxomethyl]amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[4-(difluoromethylsulfanyl)benzoyl]amino]-3-phenylpropanoate Traditional Name: 3-[[4-(difluoromethylthio)benzoyl]amino]-3-phenyl-propionic acid isopropyl ester Formula: C20H21F2NO3S MolecularWeight: 393.447446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)SC(F)F

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)SC(F)F

InChI

InChI=1S/C20H21F2NO3S/c1-13(2)26-18(24)12-17(14-6-4-3-5-7-14)23-19(25)15-8-10-16(11-9-15)27-20(21)22/h3-11,13,17,20H,12H2,1-2H3,(H,23,25)