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

Systemtic Name: azepan-1-yl-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)methanone Openeye Name: azepan-1-yl-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)methanone CAS Name: 1-azepanyl-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]methanone IUPAC Name: azepan-1-yl-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)methanone Traditional Name: azepan-1-yl-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)methanone Formula: C21H31N3O4S MolecularWeight: 421.55354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31N3O4S/c25-21(23-11-3-1-2-4-12-23)19-17-18(7-8-20(19)22-9-5-6-10-22)29(26,27)24-13-15-28-16-14-24/h7-8,17H,1-6,9-16H2