1-(4-methylphenyl)sulfonyl-2-(3-methylthiophen-2-yl)azepane

Systemtic Name: 1-(4-methylphenyl)sulfonyl-2-(3-methylthiophen-2-yl)azepane Openeye Name: 2-(3-methyl-2-thienyl)-1-(p-tolylsulfonyl)azepane CAS Name: 1-(4-methylphenyl)sulfonyl-2-(3-methyl-2-thiophenyl)azepane IUPAC Name: 1-(4-methylphenyl)sulfonyl-2-(3-methylthiophen-2-yl)azepane Traditional Name: 2-(3-methyl-2-thienyl)-1-tosyl-azepane Formula: C18H23NO2S2 MolecularWeight: 349.51072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2C3=C(C=CS3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2C3=C(C=CS3)C

InChI

InChI=1S/C18H23NO2S2/c1-14-7-9-16(10-8-14)23(20,21)19-12-5-3-4-6-17(19)18-15(2)11-13-22-18/h7-11,13,17H,3-6,12H2,1-2H3