N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-3-phenyl-propanamide

Systemtic Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]-3-phenyl-propanamide Openeye Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-3-phenyl-propanamide CAS Name: N-[2-(1-azepanyl)-5-(4-morpholinylsulfonyl)phenyl]-3-phenylpropanamide IUPAC Name: N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]-3-phenylpropanamide Traditional Name: N-[2-(azepan-1-yl)-5-morpholinosulfonyl-phenyl]-3-phenyl-propionamide Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)CCC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C25H33N3O4S/c29-25(13-10-21-8-4-3-5-9-21)26-23-20-22(33(30,31)28-16-18-32-19-17-28)11-12-24(23)27-14-6-1-2-7-15-27/h3-5,8-9,11-12,20H,1-2,6-7,10,13-19H2,(H,26,29)