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

Systemtic Name: 5-chloranyl-N-[(2S)-2-(4-fluoranyl-3-methyl-phenyl)sulfonyl-2-pyridin-3-yl-ethyl]thiophene-2-sulfonamide Openeye Name: 5-chloro-N-[(2S)-2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(3-pyridyl)ethyl]thiophene-2-sulfonamide CAS Name: 5-chloro-N-[(2S)-2-(4-fluoro-3-methylphenyl)sulfonyl-2-(3-pyridinyl)ethyl]-2-thiophenesulfonamide IUPAC Name: 5-chloro-N-[(2S)-2-(4-fluoro-3-methylphenyl)sulfonyl-2-pyridin-3-ylethyl]thiophene-2-sulfonamide Traditional Name: 5-chloro-N-[(2S)-2-(4-fluoro-3-methyl-phenyl)sulfonyl-2-(3-pyridyl)ethyl]thiophene-2-sulfonamide Formula: C18H16ClFN2O4S3 MolecularWeight: 474.977043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)C(CNS(=O)(=O)C2=CC=C(S2)Cl)C3=CN=CC=C3)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)[C@H](CNS(=O)(=O)C2=CC=C(S2)Cl)C3=CN=CC=C3)F

InChI

InChI=1S/C18H16ClFN2O4S3/c1-12-9-14(4-5-15(12)20)28(23,24)16(13-3-2-8-21-10-13)11-22-29(25,26)18-7-6-17(19)27-18/h2-10,16,22H,11H2,1H3/t16-/m1/s1