2-[4-(2-ethyl-5-methylsulfonyl-benzimidazol-1-yl)phenyl]ethyl propanoate

Systemtic Name: 2-[4-(2-ethyl-5-methylsulfonyl-benzimidazol-1-yl)phenyl]ethyl propanoate Openeye Name: 2-[4-(2-ethyl-5-methylsulfonyl-benzimidazol-1-yl)phenyl]ethyl propanoate CAS Name: propanoic acid 2-[4-(2-ethyl-5-methylsulfonyl-1-benzimidazolyl)phenyl]ethyl ester IUPAC Name: 2-[4-(2-ethyl-5-methylsulfonylbenzimidazol-1-yl)phenyl]ethyl propanoate Traditional Name: propionic acid 2-[4-(2-ethyl-5-mesyl-benzimidazol-1-yl)phenyl]ethyl ester Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1C3=CC=C(C=C3)CCOC(=O)CC)C=CC(=C2)S(=O)(=O)C

Isomeric SMILES

CCC1=NC2=C(N1C3=CC=C(C=C3)CCOC(=O)CC)C=CC(=C2)S(=O)(=O)C

InChI

InChI=1S/C21H24N2O4S/c1-4-20-22-18-14-17(28(3,25)26)10-11-19(18)23(20)16-8-6-15(7-9-16)12-13-27-21(24)5-2/h6-11,14H,4-5,12-13H2,1-3H3