N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]hexanamide

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]hexanamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]hexanamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]hexanamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]hexanamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]hexanamide Formula: C22H35N3O4S MolecularWeight: 437.596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)N3CCCCCC3

Isomeric SMILES

CCCCCC(=O)NC1=C(C=CC(=C1)S(=O)(=O)N2CCOCC2)N3CCCCCC3

InChI

InChI=1S/C22H35N3O4S/c1-2-3-6-9-22(26)23-20-18-19(30(27,28)25-14-16-29-17-15-25)10-11-21(20)24-12-7-4-5-8-13-24/h10-11,18H,2-9,12-17H2,1H3,(H,23,26)