2-(azepan-1-yl)-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)ethanamide

Systemtic Name: 2-(azepan-1-yl)-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)ethanamide Openeye Name: 2-(azepan-1-yl)-N-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)acetamide CAS Name: 2-(1-azepanyl)-N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-(azepan-1-yl)-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-(azepan-1-yl)-N-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)acetamide Formula: C22H34N4O4S MolecularWeight: 450.59476

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4

Isomeric SMILES

C1CCCN(CC1)CC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCC4

InChI

InChI=1S/C22H34N4O4S/c27-22(18-24-9-3-1-2-4-10-24)23-20-17-19(7-8-21(20)25-11-5-6-12-25)31(28,29)26-13-15-30-16-14-26/h7-8,17H,1-6,9-16,18H2,(H,23,27)