N-[(2S)-2-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-pyridin-3-yl-ethyl]-3-phenyl-propane-1-sulfonamide

Systemtic Name: N-[(2S)-2-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-pyridin-3-yl-ethyl]-3-phenyl-propane-1-sulfonamide Openeye Name: N-[(2S)-2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(3-pyridyl)ethyl]-3-phenyl-propane-1-sulfonamide CAS Name: N-[(2S)-2-(4-fluoro-3-methylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-3-phenyl-1-propanesulfonamide IUPAC Name: N-[(2S)-2-(4-fluoro-3-methylphenyl)sulfonyl-2-pyridin-3-ylethyl]-3-phenylpropane-1-sulfonamide Traditional Name: N-[(2S)-2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(3-pyridyl)ethyl]-3-phenyl-propane-1-sulfonamide Formula: C23H25FN2O4S2 MolecularWeight: 476.584003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)C(CNS(=O)(=O)CCCC2=CC=CC=C2)C3=CN=CC=C3)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)[C@H](CNS(=O)(=O)CCCC2=CC=CC=C2)C3=CN=CC=C3)F

InChI

InChI=1S/C23H25FN2O4S2/c1-18-15-21(11-12-22(18)24)32(29,30)23(20-10-5-13-25-16-20)17-26-31(27,28)14-6-9-19-7-3-2-4-8-19/h2-5,7-8,10-13,15-16,23,26H,6,9,14,17H2,1H3/t23-/m1/s1