2-(3-methylthiophen-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)azepane

Systemtic Name: 2-(3-methylthiophen-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)azepane Openeye Name: 2-(3-methyl-2-thienyl)-1-tetralin-6-ylsulfonyl-azepane CAS Name: 2-(3-methyl-2-thiophenyl)-1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)azepane IUPAC Name: 2-(3-methylthiophen-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)azepane Traditional Name: 2-(3-methyl-2-thienyl)-1-tetralin-6-ylsulfonyl-azepane Formula: C21H27NO2S2 MolecularWeight: 389.57458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2CCCCCN2S(=O)(=O)C3=CC4=C(CCCC4)C=C3

Isomeric SMILES

CC1=C(SC=C1)C2CCCCCN2S(=O)(=O)C3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C21H27NO2S2/c1-16-12-14-25-21(16)20-9-3-2-6-13-22(20)26(23,24)19-11-10-17-7-4-5-8-18(17)15-19/h10-12,14-15,20H,2-9,13H2,1H3