2-[(5-chloranyl-2-methoxy-phenyl)-(4-methylphenyl)sulfonyl-amino]-N-[(4-imidazol-1-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[(5-chloranyl-2-methoxy-phenyl)-(4-methylphenyl)sulfonyl-amino]-N-[(4-imidazol-1-ylphenyl)methyl]ethanamide Openeye Name: 2-[5-chloro-2-methoxy-N-(p-tolylsulfonyl)anilino]-N-[(4-imidazol-1-ylphenyl)methyl]acetamide CAS Name: 2-(5-chloro-2-methoxy-N-(4-methylphenyl)sulfonylanilino)-N-[[4-(1-imidazolyl)phenyl]methyl]acetamide IUPAC Name: 2-(5-chloro-2-methoxy-N-(4-methylphenyl)sulfonylanilino)-N-[(4-imidazol-1-ylphenyl)methyl]acetamide Traditional Name: 2-(5-chloro-2-methoxy-N-tosyl-anilino)-N-(4-imidazol-1-ylbenzyl)acetamide Formula: C26H25ClN4O4S MolecularWeight: 525.0191

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=C(C=C2)N3C=CN=C3)C4=C(C=CC(=C4)Cl)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC=C(C=C2)N3C=CN=C3)C4=C(C=CC(=C4)Cl)OC

InChI

InChI=1S/C26H25ClN4O4S/c1-19-3-10-23(11-4-19)36(33,34)31(24-15-21(27)7-12-25(24)35-2)17-26(32)29-16-20-5-8-22(9-6-20)30-14-13-28-18-30/h3-15,18H,16-17H2,1-2H3,(H,29,32)