ethyl 3-[2-[(4-cyanophenyl)methyl]-4-(phenylsulfonylamino)benzimidazol-1-yl]propanoate

Systemtic Name: ethyl 3-[2-[(4-cyanophenyl)methyl]-4-(phenylsulfonylamino)benzimidazol-1-yl]propanoate Openeye Name: ethyl 3-[4-(benzenesulfonamido)-2-[(4-cyanophenyl)methyl]benzimidazol-1-yl]propanoate CAS Name: 3-[4-(benzenesulfonamido)-2-[(4-cyanophenyl)methyl]-1-benzimidazolyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-(benzenesulfonamido)-2-[(4-cyanophenyl)methyl]benzimidazol-1-yl]propanoate Traditional Name: 3-[4-(benzenesulfonamido)-2-(4-cyanobenzyl)benzimidazol-1-yl]propionic acid ethyl ester Formula: C26H24N4O4S MolecularWeight: 488.55816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2=C(C(=CC=C2)NS(=O)(=O)C3=CC=CC=C3)N=C1CC4=CC=C(C=C4)C#N

Isomeric SMILES

CCOC(=O)CCN1C2=C(C(=CC=C2)NS(=O)(=O)C3=CC=CC=C3)N=C1CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C26H24N4O4S/c1-2-34-25(31)15-16-30-23-10-6-9-22(29-35(32,33)21-7-4-3-5-8-21)26(23)28-24(30)17-19-11-13-20(18-27)14-12-19/h3-14,29H,2,15-17H2,1H3