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

Systemtic Name: 2-[4-(6-chloranyl-2-ethyl-5-methylsulfonyl-benzimidazol-1-yl)phenyl]ethyl-(4-methylphenyl)sulfonyl-carbamic acid Openeye Name: 2-[4-(6-chloro-2-ethyl-5-methylsulfonyl-benzimidazol-1-yl)phenyl]ethyl-(p-tolylsulfonyl)carbamic acid CAS Name: 2-[4-(6-chloro-2-ethyl-5-methylsulfonyl-1-benzimidazolyl)phenyl]ethyl-(4-methylphenyl)sulfonylcarbamic acid IUPAC Name: 2-[4-(6-chloro-2-ethyl-5-methylsulfonylbenzimidazol-1-yl)phenyl]ethyl-(4-methylphenyl)sulfonylcarbamic acid Traditional Name: 2-[4-(6-chloro-2-ethyl-5-mesyl-benzimidazol-1-yl)phenyl]ethyl-tosyl-carbamic acid Formula: C26H26ClN3O6S2 MolecularWeight: 576.08414

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC(=C(C=C2N1C3=CC=C(C=C3)CCN(C(=O)O)S(=O)(=O)C4=CC=C(C=C4)C)Cl)S(=O)(=O)C

Isomeric SMILES

CCC1=NC2=CC(=C(C=C2N1C3=CC=C(C=C3)CCN(C(=O)O)S(=O)(=O)C4=CC=C(C=C4)C)Cl)S(=O)(=O)C

InChI

InChI=1S/C26H26ClN3O6S2/c1-4-25-28-22-16-24(37(3,33)34)21(27)15-23(22)30(25)19-9-7-18(8-10-19)13-14-29(26(31)32)38(35,36)20-11-5-17(2)6-12-20/h5-12,15-16H,4,13-14H2,1-3H3,(H,31,32)