2,2,2-tris(fluoranyl)-1-[6-methoxy-3-(piperidin-1-ylmethyl)-2-sulfanylidene-benzimidazol-1-yl]ethanone

Systemtic Name: 2,2,2-tris(fluoranyl)-1-[6-methoxy-3-(piperidin-1-ylmethyl)-2-sulfanylidene-benzimidazol-1-yl]ethanone Openeye Name: 2,2,2-trifluoro-1-[6-methoxy-3-(1-piperidylmethyl)-2-thioxo-benzimidazol-1-yl]ethanone CAS Name: 2,2,2-trifluoro-1-[6-methoxy-3-(1-piperidinylmethyl)-2-sulfanylidene-1-benzimidazolyl]ethanone IUPAC Name: 2,2,2-trifluoro-1-[6-methoxy-3-(piperidin-1-ylmethyl)-2-sulfanylidenebenzimidazol-1-yl]ethanone Traditional Name: 2,2,2-trifluoro-1-[6-methoxy-3-(piperidinomethyl)-2-thioxo-benzimidazol-1-yl]ethanone Formula: C16H18F3N3O2S MolecularWeight: 373.39323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(C(=S)N2C(=O)C(F)(F)F)CN3CCCCC3

Isomeric SMILES

COC1=CC2=C(C=C1)N(C(=S)N2C(=O)C(F)(F)F)CN3CCCCC3

InChI

InChI=1S/C16H18F3N3O2S/c1-24-11-5-6-12-13(9-11)22(14(23)16(17,18)19)15(25)21(12)10-20-7-3-2-4-8-20/h5-6,9H,2-4,7-8,10H2,1H3