[2-[2,2-dimethylpropanoyloxymethyl(methoxycarbonyl)amino]-5-propylsulfanyl-benzimidazol-1-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [2-[2,2-dimethylpropanoyloxymethyl(methoxycarbonyl)amino]-5-propylsulfanyl-benzimidazol-1-yl]methyl 2,2-dimethylpropanoate Openeye Name: [2-[2,2-dimethylpropanoyloxymethyl(methoxycarbonyl)amino]-5-propylsulfanyl-benzimidazol-1-yl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [2-[(2,2-dimethyl-1-oxopropoxy)methyl-methoxycarbonylamino]-5-(propylthio)-1-benzimidazolyl]methyl ester IUPAC Name: [2-[2,2-dimethylpropanoyloxymethyl(methoxycarbonyl)amino]-5-propylsulfanylbenzimidazol-1-yl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [2-[carbomethoxy(pivaloyloxymethyl)amino]-5-(propylthio)benzimidazol-1-yl]methyl ester Formula: C24H35N3O6S MolecularWeight: 493.6162

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC2=C(C=C1)N(C(=N2)N(COC(=O)C(C)(C)C)C(=O)OC)COC(=O)C(C)(C)C

Isomeric SMILES

CCCSC1=CC2=C(C=C1)N(C(=N2)N(COC(=O)C(C)(C)C)C(=O)OC)COC(=O)C(C)(C)C

InChI

InChI=1S/C24H35N3O6S/c1-9-12-34-16-10-11-18-17(13-16)25-21(26(18)14-32-19(28)23(2,3)4)27(22(30)31-8)15-33-20(29)24(5,6)7/h10-11,13H,9,12,14-15H2,1-8H3