[1-[bis(fluoranyl)methyl]benzimidazol-2-yl]methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: [1-[bis(fluoranyl)methyl]benzimidazol-2-yl]methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: [1-(difluoromethyl)benzimidazol-2-yl]methyl 1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid [1-(difluoromethyl)-2-benzimidazolyl]methyl ester IUPAC Name: [1-(difluoromethyl)benzimidazol-2-yl]methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-thienylsulfonyl)isonipecotic acid [1-(difluoromethyl)benzimidazol-2-yl]methyl ester Formula: C19H19F2N3O4S2 MolecularWeight: 455.498666

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=NC3=CC=CC=C3N2C(F)F)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=NC3=CC=CC=C3N2C(F)F)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C19H19F2N3O4S2/c20-19(21)24-15-5-2-1-4-14(15)22-16(24)12-28-18(25)13-7-9-23(10-8-13)30(26,27)17-6-3-11-29-17/h1-6,11,13,19H,7-10,12H2