[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 3-[5-(diethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 3-[5-(diethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 3-[5-(diethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoate CAS Name: 3-[5-(diethylsulfamoyl)-1-methyl-2-benzimidazolyl]propanoic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 3-[5-(diethylsulfamoyl)-1-methylbenzimidazol-2-yl]propanoate Traditional Name: 3-[5-(diethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propionic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C23H35N5O6S MolecularWeight: 509.6189

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)CCC(=O)OCC(=O)NC(=O)NCCC(C)C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)CCC(=O)OCC(=O)NC(=O)NCCC(C)C)C

InChI

InChI=1S/C23H35N5O6S/c1-6-28(7-2)35(32,33)17-8-9-19-18(14-17)25-20(27(19)5)10-11-22(30)34-15-21(29)26-23(31)24-13-12-16(3)4/h8-9,14,16H,6-7,10-13,15H2,1-5H3,(H2,24,26,29,31)