2-[1-(4-bromophenyl)ethylamino]-N-(3-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 2-[1-(4-bromophenyl)ethylamino]-N-(3-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: 2-[1-(4-bromophenyl)ethylamino]-N-[3-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: 2-[1-(4-bromophenyl)ethylamino]-N-[3-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-[1-(4-bromophenyl)ethylamino]-N-(3-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-[1-(4-bromophenyl)ethylamino]-N-(3-piperidinosulfonylphenyl)propionamide Formula: C22H28BrN3O3S MolecularWeight: 494.44502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)NC(C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C1=CC=C(C=C1)Br)NC(C)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H28BrN3O3S/c1-16(18-9-11-19(23)12-10-18)24-17(2)22(27)25-20-7-6-8-21(15-20)30(28,29)26-13-4-3-5-14-26/h6-12,15-17,24H,3-5,13-14H2,1-2H3,(H,25,27)