[(3S)-1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidin-3-yl]-(3-methylthiophen-2-yl)methanone

Systemtic Name: [(3S)-1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidin-3-yl]-(3-methylthiophen-2-yl)methanone Openeye Name: [(3S)-1-(3-chloro-4-fluoro-phenyl)sulfonyl-3-piperidyl]-(3-methyl-2-thienyl)methanone CAS Name: [(3S)-1-(3-chloro-4-fluorophenyl)sulfonyl-3-piperidinyl]-(3-methyl-2-thiophenyl)methanone IUPAC Name: [(3S)-1-(3-chloro-4-fluorophenyl)sulfonylpiperidin-3-yl]-(3-methylthiophen-2-yl)methanone Traditional Name: [(3S)-1-(3-chloro-4-fluoro-phenyl)sulfonyl-3-piperidyl]-(3-methyl-2-thienyl)methanone Formula: C17H17ClFNO3S2 MolecularWeight: 401.903183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=C(SC=C1)C(=O)[C@H]2CCCN(C2)S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C17H17ClFNO3S2/c1-11-6-8-24-17(11)16(21)12-3-2-7-20(10-12)25(22,23)13-4-5-15(19)14(18)9-13/h4-6,8-9,12H,2-3,7,10H2,1H3/t12-/m0/s1