N-[(2R,3S)-3-azanyl-2-oxidanyl-4-phenyl-butyl]-2,3,5,6-tetradeuterio-N-(2-methylpropyl)-4-nitro-benzenesulfonamide

Systemtic Name: N-[(2R,3S)-3-azanyl-2-oxidanyl-4-phenyl-butyl]-2,3,5,6-tetradeuterio-N-(2-methylpropyl)-4-nitro-benzenesulfonamide Openeye Name: N-[(2R,3S)-3-amino-2-hydroxy-4-phenyl-butyl]-2,3,5,6-tetradeuterio-N-isobutyl-4-nitro-benzenesulfonamide CAS Name: N-[(2R,3S)-3-amino-2-hydroxy-4-phenylbutyl]-2,3,5,6-tetradeuterio-N-(2-methylpropyl)-4-nitrobenzenesulfonamide IUPAC Name: N-[(2R,3S)-3-amino-2-hydroxy-4-phenylbutyl]-2,3,5,6-tetradeuterio-N-(2-methylpropyl)-4-nitrobenzenesulfonamide Traditional Name: N-[(2R,3S)-3-amino-2-hydroxy-4-phenyl-butyl]-2,3,5,6-tetradeuterio-N-isobutyl-4-nitro-benzenesulfonamide Formula: C20H27N3O5S MolecularWeight: 425.535127

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C(CC1=CC=CC=C1)N)O)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

[2H]C1=C(C(=C(C(=C1[N+](=O)[O-])[2H])[2H])S(=O)(=O)N(C[C@H]([C@H](CC2=CC=CC=C2)N)O)CC(C)C)[2H]

InChI

InChI=1S/C20H27N3O5S/c1-15(2)13-22(14-20(24)19(21)12-16-6-4-3-5-7-16)29(27,28)18-10-8-17(9-11-18)23(25)26/h3-11,15,19-20,24H,12-14,21H2,1-2H3/t19-,20+/m0/s1/i8D,9D,10D,11D