ethyl 4-[4-(6-fluoranyl-3-methylsulfonyl-2-oxidanylidene-benzimidazol-1-yl)piperidin-1-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-(6-fluoranyl-3-methylsulfonyl-2-oxidanylidene-benzimidazol-1-yl)piperidin-1-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-(6-fluoro-3-methylsulfonyl-2-oxo-benzimidazol-1-yl)-1-piperidyl]piperidine-1-carboxylate CAS Name: 4-[4-(6-fluoro-3-methylsulfonyl-2-oxo-1-benzimidazolyl)-1-piperidinyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(6-fluoro-3-methylsulfonyl-2-oxobenzimidazol-1-yl)piperidin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(6-fluoro-2-keto-3-mesyl-benzimidazol-1-yl)piperidino]piperidine-1-carboxylic acid ethyl ester Formula: C21H29FN4O5S MolecularWeight: 468.542163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2CCC(CC2)N3C4=C(C=CC(=C4)F)N(C3=O)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2CCC(CC2)N3C4=C(C=CC(=C4)F)N(C3=O)S(=O)(=O)C

InChI

InChI=1S/C21H29FN4O5S/c1-3-31-21(28)24-12-6-16(7-13-24)23-10-8-17(9-11-23)25-19-14-15(22)4-5-18(19)26(20(25)27)32(2,29)30/h4-5,14,16-17H,3,6-13H2,1-2H3