1-(2-methylphenyl)sulfonyl-2-thiophen-2-yl-azepane

Systemtic Name: 1-(2-methylphenyl)sulfonyl-2-thiophen-2-yl-azepane Openeye Name: 1-(o-tolylsulfonyl)-2-(2-thienyl)azepane CAS Name: 1-(2-methylphenyl)sulfonyl-2-thiophen-2-ylazepane IUPAC Name: 1-(2-methylphenyl)sulfonyl-2-thiophen-2-ylazepane Traditional Name: 1-(o-tolylsulfonyl)-2-(2-thienyl)azepane Formula: C17H21NO2S2 MolecularWeight: 335.48414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)N2CCCCCC2C3=CC=CS3

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)N2CCCCCC2C3=CC=CS3

InChI

InChI=1S/C17H21NO2S2/c1-14-8-4-5-11-17(14)22(19,20)18-12-6-2-3-9-15(18)16-10-7-13-21-16/h4-5,7-8,10-11,13,15H,2-3,6,9,12H2,1H3