2-[(4-bromophenyl)sulfonyl-phenethyl-amino]-N-[1-(2,4,5-trimethylphenyl)ethyl]ethanamide

Systemtic Name: 2-[(4-bromophenyl)sulfonyl-phenethyl-amino]-N-[1-(2,4,5-trimethylphenyl)ethyl]ethanamide Openeye Name: 2-[(4-bromophenyl)sulfonyl-phenethyl-amino]-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide CAS Name: 2-[(4-bromophenyl)sulfonyl-phenethylamino]-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide IUPAC Name: 2-[(4-bromophenyl)sulfonyl-phenethylamino]-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide Traditional Name: 2-[brosyl(phenethyl)amino]-N-[1-(2,4,5-trimethylphenyl)ethyl]acetamide Formula: C27H31BrN2O3S MolecularWeight: 543.51564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)C(C)NC(=O)CN(CCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=CC(=C(C=C1C)C(C)NC(=O)CN(CCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C27H31BrN2O3S/c1-19-16-21(3)26(17-20(19)2)22(4)29-27(31)18-30(15-14-23-8-6-5-7-9-23)34(32,33)25-12-10-24(28)11-13-25/h5-13,16-17,22H,14-15,18H2,1-4H3,(H,29,31)