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

Systemtic Name: 1-(4-ethylphenyl)sulfonyl-2-(3-methylthiophen-2-yl)azepane Openeye Name: 1-(4-ethylphenyl)sulfonyl-2-(3-methyl-2-thienyl)azepane CAS Name: 1-(4-ethylphenyl)sulfonyl-2-(3-methyl-2-thiophenyl)azepane IUPAC Name: 1-(4-ethylphenyl)sulfonyl-2-(3-methylthiophen-2-yl)azepane Traditional Name: 1-(4-ethylphenyl)sulfonyl-2-(3-methyl-2-thienyl)azepane Formula: C19H25NO2S2 MolecularWeight: 363.5373

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2C3=C(C=CS3)C

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N2CCCCCC2C3=C(C=CS3)C

InChI

InChI=1S/C19H25NO2S2/c1-3-16-8-10-17(11-9-16)24(21,22)20-13-6-4-5-7-18(20)19-15(2)12-14-23-19/h8-12,14,18H,3-7,13H2,1-2H3