N-[(S)-[3-[(S)-tert-butylsulfinyl]pyridin-4-yl]-phenyl-methyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(S)-[3-[(S)-tert-butylsulfinyl]pyridin-4-yl]-phenyl-methyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(S)-[3-[(S)-tert-butylsulfinyl]-4-pyridyl]-phenyl-methyl]-4-methyl-benzenesulfonamide CAS Name: N-[(S)-[3-[(S)-tert-butylsulfinyl]-4-pyridinyl]-phenylmethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(S)-[3-[(S)-tert-butylsulfinyl]pyridin-4-yl]-phenylmethyl]-4-methylbenzenesulfonamide Traditional Name: N-[(S)-[3-[(S)-tert-butylsulfinyl]-4-pyridyl]-phenyl-methyl]-4-methyl-benzenesulfonamide Formula: C23H26N2O3S2 MolecularWeight: 442.59414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=CC=C2)C3=C(C=NC=C3)S(=O)C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O3S2/c1-17-10-12-19(13-11-17)30(27,28)25-22(18-8-6-5-7-9-18)20-14-15-24-16-21(20)29(26)23(2,3)4/h5-16,22,25H,1-4H3/t22-,29+/m0/s1