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

Systemtic Name: N-[2-(azepan-1-yl)phenyl]-2-methoxy-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[2-(azepan-1-yl)phenyl]-2-methoxy-5-morpholinosulfonyl-benzamide CAS Name: N-[2-(1-azepanyl)phenyl]-2-methoxy-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[2-(azepan-1-yl)phenyl]-2-methoxy-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[2-(azepan-1-yl)phenyl]-2-methoxy-5-morpholinosulfonyl-benzamide Formula: C24H31N3O5S MolecularWeight: 473.58504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC3=CC=CC=C3N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC3=CC=CC=C3N4CCCCCC4

InChI

InChI=1S/C24H31N3O5S/c1-31-23-11-10-19(33(29,30)27-14-16-32-17-15-27)18-20(23)24(28)25-21-8-4-5-9-22(21)26-12-6-2-3-7-13-26/h4-5,8-11,18H,2-3,6-7,12-17H2,1H3,(H,25,28)