1-methylsulfonyl-3-(1-piperidin-4-ylpiperidin-4-yl)benzimidazol-2-one; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 1-methylsulfonyl-3-(1-piperidin-4-ylpiperidin-4-yl)benzimidazol-2-one; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 1-methylsulfonyl-3-[1-(4-piperidyl)-4-piperidyl]benzimidazol-2-one; 2,2,2-trifluoroacetic acid CAS Name: 1-methylsulfonyl-3-[1-(4-piperidinyl)-4-piperidinyl]-2-benzimidazolone; 2,2,2-trifluoroacetic acid IUPAC Name: 1-methylsulfonyl-3-(1-piperidin-4-ylpiperidin-4-yl)benzimidazol-2-one; 2,2,2-trifluoroacetic acid Traditional Name: 1-mesyl-3-[1-(4-piperidyl)-4-piperidyl]benzimidazol-2-one; 2,2,2-trifluoroacetic acid Formula: C22H28F6N4O7S MolecularWeight: 606.535739

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1C2=CC=CC=C2N(C1=O)C3CCN(CC3)C4CCNCC4.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

CS(=O)(=O)N1C2=CC=CC=C2N(C1=O)C3CCN(CC3)C4CCNCC4.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C18H26N4O3S.2C2HF3O2/c1-26(24,25)22-17-5-3-2-4-16(17)21(18(22)23)15-8-12-20(13-9-15)14-6-10-19-11-7-14;2*3-2(4,5)1(6)7/h2-5,14-15,19H,6-13H2,1H3;2*(H,6,7)