2-[azepan-1-ylsulfonyl(methyl)amino]-N-(3,4-diethoxyphenyl)ethanamide

Systemtic Name: 2-[azepan-1-ylsulfonyl(methyl)amino]-N-(3,4-diethoxyphenyl)ethanamide Openeye Name: 2-[azepan-1-ylsulfonyl(methyl)amino]-N-(3,4-diethoxyphenyl)acetamide CAS Name: 2-[1-azepanylsulfonyl(methyl)amino]-N-(3,4-diethoxyphenyl)acetamide IUPAC Name: 2-[azepan-1-ylsulfonyl(methyl)amino]-N-(3,4-diethoxyphenyl)acetamide Traditional Name: 2-[azepan-1-ylsulfonyl(methyl)amino]-N-(3,4-diethoxyphenyl)acetamide Formula: C19H31N3O5S MolecularWeight: 413.53154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CN(C)S(=O)(=O)N2CCCCCC2)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CN(C)S(=O)(=O)N2CCCCCC2)OCC

InChI

InChI=1S/C19H31N3O5S/c1-4-26-17-11-10-16(14-18(17)27-5-2)20-19(23)15-21(3)28(24,25)22-12-8-6-7-9-13-22/h10-11,14H,4-9,12-13,15H2,1-3H3,(H,20,23)