2-[(4-bromophenyl)sulfonyl-(phenylmethyl)amino]-4-methyl-N-oxidanidyl-pentanamide

Systemtic Name: 2-[(4-bromophenyl)sulfonyl-(phenylmethyl)amino]-4-methyl-N-oxidanidyl-pentanamide Openeye Name: 2-[benzyl-(4-bromophenyl)sulfonyl-amino]-4-methyl-N-oxido-pentanamide CAS Name: 2-[(4-bromophenyl)sulfonyl-(phenylmethyl)amino]-4-methyl-N-oxidopentanamide IUPAC Name: 2-[benzyl-(4-bromophenyl)sulfonylamino]-4-methyl-N-oxidopentanamide Traditional Name: 2-[benzyl(brosyl)amino]-4-methyl-N-oxido-valeramide Formula: C19H22BrN2O4S- MolecularWeight: 454.35798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N[O-])N(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)CC(C(=O)N[O-])N(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C19H22BrN2O4S/c1-14(2)12-18(19(23)21-24)22(13-15-6-4-3-5-7-15)27(25,26)17-10-8-16(20)9-11-17/h3-11,14,18H,12-13H2,1-2H3,(H-,21,23,24)/q-1