3-azanyl-2-(2-methylpropyl)-N-[(2R)-2-oxidanyl-3-[(phenylmethyl)amino]propyl]benzenesulfonamide

Systemtic Name: 3-azanyl-2-(2-methylpropyl)-N-[(2R)-2-oxidanyl-3-[(phenylmethyl)amino]propyl]benzenesulfonamide Openeye Name: 3-amino-N-[(2R)-3-(benzylamino)-2-hydroxy-propyl]-2-isobutyl-benzenesulfonamide CAS Name: 3-amino-N-[(2R)-2-hydroxy-3-[(phenylmethyl)amino]propyl]-2-(2-methylpropyl)benzenesulfonamide IUPAC Name: 3-amino-N-[(2R)-3-(benzylamino)-2-hydroxypropyl]-2-(2-methylpropyl)benzenesulfonamide Traditional Name: 3-amino-N-[(2R)-3-(benzylamino)-2-hydroxy-propyl]-2-isobutyl-benzenesulfonamide Formula: C20H29N3O3S MolecularWeight: 391.52756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=CC=C1S(=O)(=O)NCC(CNCC2=CC=CC=C2)O)N

Isomeric SMILES

CC(C)CC1=C(C=CC=C1S(=O)(=O)NC[C@@H](CNCC2=CC=CC=C2)O)N

InChI

InChI=1S/C20H29N3O3S/c1-15(2)11-18-19(21)9-6-10-20(18)27(25,26)23-14-17(24)13-22-12-16-7-4-3-5-8-16/h3-10,15,17,22-24H,11-14,21H2,1-2H3/t17-/m1/s1