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

Systemtic Name: N-[(2S)-2-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-pyridin-3-yl-ethyl]thiophene-2-sulfonamide Openeye Name: N-[(2S)-2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(3-pyridyl)ethyl]thiophene-2-sulfonamide CAS Name: N-[(2S)-2-(4-fluoro-3-methylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-2-thiophenesulfonamide IUPAC Name: N-[(2S)-2-(4-fluoro-3-methylphenyl)sulfonyl-2-pyridin-3-ylethyl]thiophene-2-sulfonamide Traditional Name: N-[(2S)-2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(3-pyridyl)ethyl]thiophene-2-sulfonamide Formula: C18H17FN2O4S3 MolecularWeight: 440.531983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)C(CNS(=O)(=O)C2=CC=CS2)C3=CN=CC=C3)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)[C@H](CNS(=O)(=O)C2=CC=CS2)C3=CN=CC=C3)F

InChI

InChI=1S/C18H17FN2O4S3/c1-13-10-15(6-7-16(13)19)27(22,23)17(14-4-2-8-20-11-14)12-21-28(24,25)18-5-3-9-26-18/h2-11,17,21H,12H2,1H3/t17-/m1/s1