N-[(1R,2R)-1-(4-methoxyphenyl)-2-oxidanyl-3-phenylmethoxy-propyl]-2-methyl-propane-2-sulfinamide

Systemtic Name: N-[(1R,2R)-1-(4-methoxyphenyl)-2-oxidanyl-3-phenylmethoxy-propyl]-2-methyl-propane-2-sulfinamide Openeye Name: N-[(1R,2R)-3-benzyloxy-2-hydroxy-1-(4-methoxyphenyl)propyl]-2-methyl-propane-2-sulfinamide CAS Name: N-[(1R,2R)-2-hydroxy-1-(4-methoxyphenyl)-3-phenylmethoxypropyl]-2-methyl-2-propanesulfinamide IUPAC Name: N-[(1R,2R)-2-hydroxy-1-(4-methoxyphenyl)-3-phenylmethoxypropyl]-2-methylpropane-2-sulfinamide Traditional Name: N-[(1R,2R)-3-benzoxy-2-hydroxy-1-(4-methoxyphenyl)propyl]-2-methyl-propane-2-sulfinamide Formula: C21H29NO4S MolecularWeight: 391.52426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)S(=O)NC(C1=CC=C(C=C1)OC)C(COCC2=CC=CC=C2)O

Isomeric SMILES

CC(C)(C)[S@](=O)N[C@H](C1=CC=C(C=C1)OC)[C@H](COCC2=CC=CC=C2)O

InChI

InChI=1S/C21H29NO4S/c1-21(2,3)27(24)22-20(17-10-12-18(25-4)13-11-17)19(23)15-26-14-16-8-6-5-7-9-16/h5-13,19-20,22-23H,14-15H2,1-4H3/t19-,20+,27-/m0/s1