1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-2-(3-methylthiophen-2-yl)azepane

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)sulfonyl-2-(3-methylthiophen-2-yl)azepane Openeye Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-2-(3-methyl-2-thienyl)azepane CAS Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-2-(3-methyl-2-thiophenyl)azepane IUPAC Name: 1-(3-chloro-4-fluorophenyl)sulfonyl-2-(3-methylthiophen-2-yl)azepane Traditional Name: 1-(3-chloro-4-fluoro-phenyl)sulfonyl-2-(3-methyl-2-thienyl)azepane Formula: C17H19ClFNO2S2 MolecularWeight: 387.919663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2CCCCCN2S(=O)(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

CC1=C(SC=C1)C2CCCCCN2S(=O)(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C17H19ClFNO2S2/c1-12-8-10-23-17(12)16-5-3-2-4-9-20(16)24(21,22)13-6-7-15(19)14(18)11-13/h6-8,10-11,16H,2-5,9H2,1H3