methyl 4-[[2-(phenylmethyl)sulfonylbenzimidazol-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[2-(phenylmethyl)sulfonylbenzimidazol-1-yl]methyl]benzoate Openeye Name: methyl 4-[(2-benzylsulfonylbenzimidazol-1-yl)methyl]benzoate CAS Name: 4-[[2-(phenylmethyl)sulfonyl-1-benzimidazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-benzylsulfonylbenzimidazol-1-yl)methyl]benzoate Traditional Name: 4-[(2-benzylsulfonylbenzimidazol-1-yl)methyl]benzoic acid methyl ester Formula: C23H20N2O4S MolecularWeight: 420.4809

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H20N2O4S/c1-29-22(26)19-13-11-17(12-14-19)15-25-21-10-6-5-9-20(21)24-23(25)30(27,28)16-18-7-3-2-4-8-18/h2-14H,15-16H2,1H3