2-[[3-(azepan-1-ylsulfonyl)phenyl]amino]-N-(2-methylbutan-2-yl)ethanamide

Systemtic Name: 2-[[3-(azepan-1-ylsulfonyl)phenyl]amino]-N-(2-methylbutan-2-yl)ethanamide Openeye Name: 2-[3-(azepan-1-ylsulfonyl)anilino]-N-(1,1-dimethylpropyl)acetamide CAS Name: 2-[3-(1-azepanylsulfonyl)anilino]-N-(2-methylbutan-2-yl)acetamide IUPAC Name: 2-[3-(azepan-1-ylsulfonyl)anilino]-N-(2-methylbutan-2-yl)acetamide Traditional Name: N-tert-amyl-2-[3-(azepan-1-ylsulfonyl)anilino]acetamide Formula: C19H31N3O3S MolecularWeight: 381.53274

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)CNC1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CCC(C)(C)NC(=O)CNC1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C19H31N3O3S/c1-4-19(2,3)21-18(23)15-20-16-10-9-11-17(14-16)26(24,25)22-12-7-5-6-8-13-22/h9-11,14,20H,4-8,12-13,15H2,1-3H3,(H,21,23)