methyl 4-[2-[[2-phenyl-5-(phenylsulfonyl)-1H-imidazol-4-yl]sulfanyl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[[2-phenyl-5-(phenylsulfonyl)-1H-imidazol-4-yl]sulfanyl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[[5-(benzenesulfonyl)-2-phenyl-1H-imidazol-4-yl]sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[[5-(benzenesulfonyl)-2-phenyl-1H-imidazol-4-yl]thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[[5-(benzenesulfonyl)-2-phenyl-1H-imidazol-4-yl]sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(5-besyl-2-phenyl-1H-imidazol-4-yl)thio]acetyl]amino]benzoic acid methyl ester Formula: C25H21N3O5S2 MolecularWeight: 507.58134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=C(NC(=N2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=C(NC(=N2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H21N3O5S2/c1-33-25(30)18-12-14-19(15-13-18)26-21(29)16-34-23-24(35(31,32)20-10-6-3-7-11-20)28-22(27-23)17-8-4-2-5-9-17/h2-15H,16H2,1H3,(H,26,29)(H,27,28)