methyl 4-[[5-[butyl(methyl)sulfamoyl]-1-cyclopentyl-benzimidazol-2-yl]sulfanylmethyl]-3-methoxy-benzoate

Systemtic Name: methyl 4-[[5-[butyl(methyl)sulfamoyl]-1-cyclopentyl-benzimidazol-2-yl]sulfanylmethyl]-3-methoxy-benzoate Openeye Name: methyl 4-[[5-[butyl(methyl)sulfamoyl]-1-cyclopentyl-benzimidazol-2-yl]sulfanylmethyl]-3-methoxy-benzoate CAS Name: 4-[[[5-[butyl(methyl)sulfamoyl]-1-cyclopentyl-2-benzimidazolyl]thio]methyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[[5-[butyl(methyl)sulfamoyl]-1-cyclopentylbenzimidazol-2-yl]sulfanylmethyl]-3-methoxybenzoate Traditional Name: 4-[[[5-[butyl(methyl)sulfamoyl]-1-cyclopentyl-benzimidazol-2-yl]thio]methyl]-3-methoxy-benzoic acid methyl ester Formula: C27H35N3O5S2 MolecularWeight: 545.7139

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=C(C=C(C=C3)C(=O)OC)OC)C4CCCC4

Isomeric SMILES

CCCCN(C)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=C(C=C(C=C3)C(=O)OC)OC)C4CCCC4

InChI

InChI=1S/C27H35N3O5S2/c1-5-6-15-29(2)37(32,33)22-13-14-24-23(17-22)28-27(30(24)21-9-7-8-10-21)36-18-20-12-11-19(26(31)35-4)16-25(20)34-3/h11-14,16-17,21H,5-10,15,18H2,1-4H3