2-[(2,5-dimethoxyphenyl)-(4-methylphenyl)sulfonyl-amino]-N-[(2-imidazol-1-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[(2,5-dimethoxyphenyl)-(4-methylphenyl)sulfonyl-amino]-N-[(2-imidazol-1-ylphenyl)methyl]ethanamide Openeye Name: 2-[2,5-dimethoxy-N-(p-tolylsulfonyl)anilino]-N-[(2-imidazol-1-ylphenyl)methyl]acetamide CAS Name: 2-(2,5-dimethoxy-N-(4-methylphenyl)sulfonylanilino)-N-[[2-(1-imidazolyl)phenyl]methyl]acetamide IUPAC Name: 2-(2,5-dimethoxy-N-(4-methylphenyl)sulfonylanilino)-N-[(2-imidazol-1-ylphenyl)methyl]acetamide Traditional Name: 2-(2,5-dimethoxy-N-tosyl-anilino)-N-(2-imidazol-1-ylbenzyl)acetamide Formula: C27H28N4O5S MolecularWeight: 520.60002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC=CC=C2N3C=CN=C3)C4=C(C=CC(=C4)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC=CC=C2N3C=CN=C3)C4=C(C=CC(=C4)OC)OC

InChI

InChI=1S/C27H28N4O5S/c1-20-8-11-23(12-9-20)37(33,34)31(25-16-22(35-2)10-13-26(25)36-3)18-27(32)29-17-21-6-4-5-7-24(21)30-15-14-28-19-30/h4-16,19H,17-18H2,1-3H3,(H,29,32)