2-[(4-bromophenyl)-methylsulfonyl-amino]-N-(pyridin-4-ylmethyl)ethanamide

Systemtic Name: 2-[(4-bromophenyl)-methylsulfonyl-amino]-N-(pyridin-4-ylmethyl)ethanamide Openeye Name: 2-(4-bromo-N-methylsulfonyl-anilino)-N-(4-pyridylmethyl)acetamide CAS Name: 2-(4-bromo-N-methylsulfonylanilino)-N-(pyridin-4-ylmethyl)acetamide IUPAC Name: 2-(4-bromo-N-methylsulfonylanilino)-N-(pyridin-4-ylmethyl)acetamide Traditional Name: 2-(4-bromo-N-mesyl-anilino)-N-(4-pyridylmethyl)acetamide Formula: C15H16BrN3O3S MolecularWeight: 398.27484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NCC1=CC=NC=C1)C2=CC=C(C=C2)Br

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NCC1=CC=NC=C1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C15H16BrN3O3S/c1-23(21,22)19(14-4-2-13(16)3-5-14)11-15(20)18-10-12-6-8-17-9-7-12/h2-9H,10-11H2,1H3,(H,18,20)