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

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-2-(2-chloranylphenoxy)ethanamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-2-(2-chlorophenoxy)acetamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]-2-(2-chlorophenoxy)acetamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]-2-(2-chlorophenoxy)acetamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-2-(2-chlorophenoxy)acetamide Formula: C24H30ClN3O5S MolecularWeight: 508.0301

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)COC4=CC=CC=C4Cl

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)COC4=CC=CC=C4Cl

InChI

InChI=1S/C24H30ClN3O5S/c25-20-7-3-4-8-23(20)33-18-24(29)26-21-17-19(34(30,31)28-13-15-32-16-14-28)9-10-22(21)27-11-5-1-2-6-12-27/h3-4,7-10,17H,1-2,5-6,11-16,18H2,(H,26,29)