3-[1-[(5-chloranyl-1-benzothiophen-3-yl)methyl]piperidin-4-yl]-2-methyl-5,5-diphenyl-imidazol-4-one; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 3-[1-[(5-chloranyl-1-benzothiophen-3-yl)methyl]piperidin-4-yl]-2-methyl-5,5-diphenyl-imidazol-4-one; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 3-[1-[(5-chlorobenzothiophen-3-yl)methyl]-4-piperidyl]-2-methyl-5,5-diphenyl-imidazol-4-one; 2,2,2-trifluoroacetic acid CAS Name: 3-[1-[(5-chloro-1-benzothiophen-3-yl)methyl]-4-piperidinyl]-2-methyl-5,5-diphenyl-4-imidazolone; 2,2,2-trifluoroacetic acid IUPAC Name: 3-[1-[(5-chloro-1-benzothiophen-3-yl)methyl]piperidin-4-yl]-2-methyl-5,5-diphenylimidazol-4-one; 2,2,2-trifluoroacetic acid Traditional Name: 3-[1-[(5-chlorobenzothiophen-3-yl)methyl]-4-piperidyl]-2-methyl-5,5-diphenyl-2-imidazolin-4-one; 2,2,2-trifluoroacetic acid Formula: C32H29ClF3N3O3S MolecularWeight: 628.10417

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(C(=O)N1C2CCN(CC2)CC3=CSC4=C3C=C(C=C4)Cl)(C5=CC=CC=C5)C6=CC=CC=C6.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC1=NC(C(=O)N1C2CCN(CC2)CC3=CSC4=C3C=C(C=C4)Cl)(C5=CC=CC=C5)C6=CC=CC=C6.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C30H28ClN3OS.C2HF3O2/c1-21-32-30(23-8-4-2-5-9-23,24-10-6-3-7-11-24)29(35)34(21)26-14-16-33(17-15-26)19-22-20-36-28-13-12-25(31)18-27(22)28;3-2(4,5)1(6)7/h2-13,18,20,26H,14-17,19H2,1H3;(H,6,7)