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

Systemtic Name: methyl 3-[4-(3-methylsulfonyl-2-oxidanylidene-benzimidazol-1-yl)piperidin-1-yl]piperidine-1-carboxylate Openeye Name: methyl 3-[4-(3-methylsulfonyl-2-oxo-benzimidazol-1-yl)-1-piperidyl]piperidine-1-carboxylate CAS Name: 3-[4-(3-methylsulfonyl-2-oxo-1-benzimidazolyl)-1-piperidinyl]-1-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 3-[4-(3-methylsulfonyl-2-oxobenzimidazol-1-yl)piperidin-1-yl]piperidine-1-carboxylate Traditional Name: 3-[4-(2-keto-3-mesyl-benzimidazol-1-yl)piperidino]piperidine-1-carboxylic acid methyl ester Formula: C20H28N4O5S MolecularWeight: 436.52512

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCCC(C1)N2CCC(CC2)N3C4=CC=CC=C4N(C3=O)S(=O)(=O)C

Isomeric SMILES

COC(=O)N1CCCC(C1)N2CCC(CC2)N3C4=CC=CC=C4N(C3=O)S(=O)(=O)C

InChI

InChI=1S/C20H28N4O5S/c1-29-20(26)22-11-5-6-16(14-22)21-12-9-15(10-13-21)23-17-7-3-4-8-18(17)24(19(23)25)30(2,27)28/h3-4,7-8,15-16H,5-6,9-14H2,1-2H3