N-[(2S)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-1-phenyl-methanesulfonamide

Systemtic Name: N-[(2S)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-yl-ethyl]-1-phenyl-methanesulfonamide Openeye Name: N-[(2S)-2-(4-methoxyphenyl)sulfonyl-2-(3-pyridyl)ethyl]-1-phenyl-methanesulfonamide CAS Name: N-[(2S)-2-(4-methoxyphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-1-phenylmethanesulfonamide IUPAC Name: N-[(2S)-2-(4-methoxyphenyl)sulfonyl-2-pyridin-3-ylethyl]-1-phenylmethanesulfonamide Traditional Name: N-[(2S)-2-(4-methoxyphenyl)sulfonyl-2-(3-pyridyl)ethyl]-1-phenyl-methanesulfonamide Formula: C21H22N2O5S2 MolecularWeight: 446.53978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C(CNS(=O)(=O)CC2=CC=CC=C2)C3=CN=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)[C@H](CNS(=O)(=O)CC2=CC=CC=C2)C3=CN=CC=C3

InChI

InChI=1S/C21H22N2O5S2/c1-28-19-9-11-20(12-10-19)30(26,27)21(18-8-5-13-22-14-18)15-23-29(24,25)16-17-6-3-2-4-7-17/h2-14,21,23H,15-16H2,1H3/t21-/m1/s1