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

Systemtic Name: 2-[[3-(azepan-1-ylsulfonyl)phenyl]amino]-N-butan-2-yl-ethanamide Openeye Name: 2-[3-(azepan-1-ylsulfonyl)anilino]-N-sec-butyl-acetamide CAS Name: 2-[3-(1-azepanylsulfonyl)anilino]-N-butan-2-ylacetamide IUPAC Name: 2-[3-(azepan-1-ylsulfonyl)anilino]-N-butan-2-ylacetamide Traditional Name: 2-[3-(azepan-1-ylsulfonyl)anilino]-N-sec-butyl-acetamide Formula: C18H29N3O3S MolecularWeight: 367.50616

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29N3O3S/c1-3-15(2)20-18(22)14-19-16-9-8-10-17(13-16)25(23,24)21-11-6-4-5-7-12-21/h8-10,13,15,19H,3-7,11-12,14H2,1-2H3,(H,20,22)