(2R,3S)-N-[(1R)-6-[(1R)-1-(tert-butylamino)ethyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-bis(oxidanyl)-4-[3-(trifluoromethyl)phenyl]sulfonyl-butanamide

Systemtic Name: (2R,3S)-N-[(1R)-6-[(1R)-1-(tert-butylamino)ethyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-bis(oxidanyl)-4-[3-(trifluoromethyl)phenyl]sulfonyl-butanamide Openeye Name: (2R,3S)-N-[(1R)-6-[(1R)-1-(tert-butylamino)ethyl]tetralin-1-yl]-2,3-dihydroxy-4-[3-(trifluoromethyl)phenyl]sulfonyl-butanamide CAS Name: (2R,3S)-N-[(1R)-6-[(1R)-1-(tert-butylamino)ethyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dihydroxy-4-[3-(trifluoromethyl)phenyl]sulfonylbutanamide IUPAC Name: (2R,3S)-N-[(1R)-6-[(1R)-1-(tert-butylamino)ethyl]-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dihydroxy-4-[3-(trifluoromethyl)phenyl]sulfonylbutanamide Traditional Name: (2R,3S)-N-[(1R)-6-[(1R)-1-(tert-butylamino)ethyl]tetralin-1-yl]-2,3-dihydroxy-4-[3-(trifluoromethyl)phenyl]sulfonyl-butyramide Formula: C27H35F3N2O5S MolecularWeight: 556.63741

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C(CCC2)NC(=O)C(C(CS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)O)O)NC(C)(C)C

Isomeric SMILES

C[C@H](C1=CC2=C(C=C1)[C@@H](CCC2)NC(=O)[C@@H]([C@@H](CS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)O)O)NC(C)(C)C

InChI

InChI=1S/C27H35F3N2O5S/c1-16(32-26(2,3)4)17-11-12-21-18(13-17)7-5-10-22(21)31-25(35)24(34)23(33)15-38(36,37)20-9-6-8-19(14-20)27(28,29)30/h6,8-9,11-14,16,22-24,32-34H,5,7,10,15H2,1-4H3,(H,31,35)/t16-,22-,23-,24-/m1/s1