2-[4-(5-aminocarbonyl-6-chloranyl-2-ethyl-benzimidazol-1-yl)phenyl]ethyl-(4-methylphenyl)sulfonyl-carbamic acid

Systemtic Name: 2-[4-(5-aminocarbonyl-6-chloranyl-2-ethyl-benzimidazol-1-yl)phenyl]ethyl-(4-methylphenyl)sulfonyl-carbamic acid Openeye Name: 2-[4-(5-carbamoyl-6-chloro-2-ethyl-benzimidazol-1-yl)phenyl]ethyl-(p-tolylsulfonyl)carbamic acid CAS Name: 2-[4-(5-carbamoyl-6-chloro-2-ethyl-1-benzimidazolyl)phenyl]ethyl-(4-methylphenyl)sulfonylcarbamic acid IUPAC Name: 2-[4-(5-carbamoyl-6-chloro-2-ethylbenzimidazol-1-yl)phenyl]ethyl-(4-methylphenyl)sulfonylcarbamic acid Traditional Name: 2-[4-(5-carbamoyl-6-chloro-2-ethyl-benzimidazol-1-yl)phenyl]ethyl-tosyl-carbamic acid Formula: C26H25ClN4O5S MolecularWeight: 541.0185

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1C3=CC=C(C=C3)CCN(C(=O)O)S(=O)(=O)C4=CC=C(C=C4)C)C=C(C(=C2)C(=O)N)Cl

Isomeric SMILES

CCC1=NC2=C(N1C3=CC=C(C=C3)CCN(C(=O)O)S(=O)(=O)C4=CC=C(C=C4)C)C=C(C(=C2)C(=O)N)Cl

InChI

InChI=1S/C26H25ClN4O5S/c1-3-24-29-22-14-20(25(28)32)21(27)15-23(22)31(24)18-8-6-17(7-9-18)12-13-30(26(33)34)37(35,36)19-10-4-16(2)5-11-19/h4-11,14-15H,3,12-13H2,1-2H3,(H2,28,32)(H,33,34)