tert-butyl 4-[4-(3-methylsulfonyl-2-oxidanylidene-benzimidazol-1-yl)piperidin-1-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(3-methylsulfonyl-2-oxidanylidene-benzimidazol-1-yl)piperidin-1-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(3-methylsulfonyl-2-oxo-benzimidazol-1-yl)-1-piperidyl]piperidine-1-carboxylate CAS Name: 4-[4-(3-methylsulfonyl-2-oxo-1-benzimidazolyl)-1-piperidinyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(3-methylsulfonyl-2-oxobenzimidazol-1-yl)piperidin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(2-keto-3-mesyl-benzimidazol-1-yl)piperidino]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H34N4O5S MolecularWeight: 478.60486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)N2CCC(CC2)N3C4=CC=CC=C4N(C3=O)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N2CCC(CC2)N3C4=CC=CC=C4N(C3=O)S(=O)(=O)C

InChI

InChI=1S/C23H34N4O5S/c1-23(2,3)32-22(29)25-15-9-17(10-16-25)24-13-11-18(12-14-24)26-19-7-5-6-8-20(19)27(21(26)28)33(4,30)31/h5-8,17-18H,9-16H2,1-4H3