N-[(1S,3Z)-3-[(R)-tert-butylsulfinyl]imino-1-(4-nitrophenyl)-3-phenyl-propyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(1S,3Z)-3-[(R)-tert-butylsulfinyl]imino-1-(4-nitrophenyl)-3-phenyl-propyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1S,3Z)-3-[(R)-tert-butylsulfinyl]imino-1-(4-nitrophenyl)-3-phenyl-propyl]-4-methyl-benzenesulfonamide CAS Name: N-[(1S,3Z)-3-[(R)-tert-butylsulfinyl]imino-1-(4-nitrophenyl)-3-phenylpropyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(1S,3Z)-3-[(R)-tert-butylsulfinyl]imino-1-(4-nitrophenyl)-3-phenylpropyl]-4-methylbenzenesulfonamide Traditional Name: N-[(1S,3Z)-3-[(R)-tert-butylsulfinyl]imino-1-(4-nitrophenyl)-3-phenyl-propyl]-4-methyl-benzenesulfonamide Formula: C26H29N3O5S2 MolecularWeight: 527.65556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(=NS(=O)C(C)(C)C)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C/C(=N/[S@](=O)C(C)(C)C)/C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C26H29N3O5S2/c1-19-10-16-23(17-11-19)36(33,34)28-25(21-12-14-22(15-13-21)29(30)31)18-24(20-8-6-5-7-9-20)27-35(32)26(2,3)4/h5-17,25,28H,18H2,1-4H3/b27-24-/t25-,35+/m0/s1