3-[azepan-1-ylsulfonyl-(phenylmethyl)amino]propanamide

Systemtic Name: 3-[azepan-1-ylsulfonyl-(phenylmethyl)amino]propanamide Openeye Name: 3-[azepan-1-ylsulfonyl(benzyl)amino]propanamide CAS Name: 3-[1-azepanylsulfonyl-(phenylmethyl)amino]propanamide IUPAC Name: 3-[azepan-1-ylsulfonyl(benzyl)amino]propanamide Traditional Name: 3-[azepan-1-ylsulfonyl(benzyl)amino]propionamide Formula: C16H25N3O3S MolecularWeight: 339.453

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N(CCC(=O)N)CC2=CC=CC=C2

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N(CCC(=O)N)CC2=CC=CC=C2

InChI

InChI=1S/C16H25N3O3S/c17-16(20)10-13-19(14-15-8-4-3-5-9-15)23(21,22)18-11-6-1-2-7-12-18/h3-5,8-9H,1-2,6-7,10-14H2,(H2,17,20)