N-[(2R)-3-[bis(2-methylpropyl)amino]-2-oxidanyl-propyl]-N-phenyl-naphthalene-2-sulfonamide

Systemtic Name: N-[(2R)-3-[bis(2-methylpropyl)amino]-2-oxidanyl-propyl]-N-phenyl-naphthalene-2-sulfonamide Openeye Name: N-[(2R)-3-(diisobutylamino)-2-hydroxy-propyl]-N-phenyl-naphthalene-2-sulfonamide CAS Name: N-[(2R)-3-[bis(2-methylpropyl)amino]-2-hydroxypropyl]-N-phenyl-2-naphthalenesulfonamide IUPAC Name: N-[(2R)-3-[bis(2-methylpropyl)amino]-2-hydroxypropyl]-N-phenylnaphthalene-2-sulfonamide Traditional Name: N-[(2R)-3-(diisobutylamino)-2-hydroxy-propyl]-N-phenyl-naphthalene-2-sulfonamide Formula: C27H36N2O3S MolecularWeight: 468.65134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)CC(CN(C1=CC=CC=C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)O

Isomeric SMILES

CC(C)CN(C[C@H](CN(C1=CC=CC=C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)O)CC(C)C

InChI

InChI=1S/C27H36N2O3S/c1-21(2)17-28(18-22(3)4)19-26(30)20-29(25-12-6-5-7-13-25)33(31,32)27-15-14-23-10-8-9-11-24(23)16-27/h5-16,21-22,26,30H,17-20H2,1-4H3/t26-/m1/s1