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

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]oxane-4-carboxamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]tetrahydropyran-4-carboxamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]-4-oxanecarboxamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]oxane-4-carboxamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]tetrahydropyran-4-carboxamide Formula: C22H33N3O5S MolecularWeight: 451.57952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4CCOCC4

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4CCOCC4

InChI

InChI=1S/C22H33N3O5S/c26-22(18-7-13-29-14-8-18)23-20-17-19(31(27,28)25-11-15-30-16-12-25)5-6-21(20)24-9-3-1-2-4-10-24/h5-6,17-18H,1-4,7-16H2,(H,23,26)