ethyl 2-azanyl-2-(methylsulfamoylmethyl)-5-(6-octyl-1H-benzimidazol-2-yl)-3,4-bis(oxidanyl)pentanoate

Systemtic Name: ethyl 2-azanyl-2-(methylsulfamoylmethyl)-5-(6-octyl-1H-benzimidazol-2-yl)-3,4-bis(oxidanyl)pentanoate Openeye Name: ethyl 2-amino-3,4-dihydroxy-2-(methylsulfamoylmethyl)-5-(6-octyl-1H-benzimidazol-2-yl)pentanoate CAS Name: 2-amino-3,4-dihydroxy-2-(methylsulfamoylmethyl)-5-(6-octyl-1H-benzimidazol-2-yl)pentanoic acid ethyl ester IUPAC Name: ethyl 2-amino-3,4-dihydroxy-2-(methylsulfamoylmethyl)-5-(6-octyl-1H-benzimidazol-2-yl)pentanoate Traditional Name: 2-amino-3,4-dihydroxy-2-(methylsulfamoylmethyl)-5-(6-octyl-1H-benzimidazol-2-yl)valeric acid ethyl ester Formula: C24H40N4O6S MolecularWeight: 512.6626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC2=C(C=C1)N=C(N2)CC(C(C(CS(=O)(=O)NC)(C(=O)OCC)N)O)O

Isomeric SMILES

CCCCCCCCC1=CC2=C(C=C1)N=C(N2)CC(C(C(CS(=O)(=O)NC)(C(=O)OCC)N)O)O

InChI

InChI=1S/C24H40N4O6S/c1-4-6-7-8-9-10-11-17-12-13-18-19(14-17)28-21(27-18)15-20(29)22(30)24(25,23(31)34-5-2)16-35(32,33)26-3/h12-14,20,22,26,29-30H,4-11,15-16,25H2,1-3H3,(H,27,28)