[1-[4-[[(3S,5R)-3,5-dimethylpiperazin-1-yl]methyl]phenyl]imidazol-2-yl]-[4-[(2-fluorophenyl)amino]piperidin-1-yl]methanone

Systemtic Name: [1-[4-[[(3S,5R)-3,5-dimethylpiperazin-1-yl]methyl]phenyl]imidazol-2-yl]-[4-[(2-fluorophenyl)amino]piperidin-1-yl]methanone Openeye Name: [1-[4-[[(3S,5R)-3,5-dimethylpiperazin-1-yl]methyl]phenyl]imidazol-2-yl]-[4-(2-fluoroanilino)-1-piperidyl]methanone CAS Name: [1-[4-[[(3S,5R)-3,5-dimethyl-1-piperazinyl]methyl]phenyl]-2-imidazolyl]-[4-(2-fluoroanilino)-1-piperidinyl]methanone IUPAC Name: [1-[4-[[(3S,5R)-3,5-dimethylpiperazin-1-yl]methyl]phenyl]imidazol-2-yl]-[4-(2-fluoroanilino)piperidin-1-yl]methanone Traditional Name: [1-[4-[[(3S,5R)-3,5-dimethylpiperazino]methyl]phenyl]imidazol-2-yl]-[4-(2-fluoroanilino)piperidino]methanone Formula: C28H35FN6O MolecularWeight: 490.615503

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1)C)CC2=CC=C(C=C2)N3C=CN=C3C(=O)N4CCC(CC4)NC5=CC=CC=C5F

Isomeric SMILES

C[C@@H]1CN(C[C@@H](N1)C)CC2=CC=C(C=C2)N3C=CN=C3C(=O)N4CCC(CC4)NC5=CC=CC=C5F

InChI

InChI=1S/C28H35FN6O/c1-20-17-33(18-21(2)31-20)19-22-7-9-24(10-8-22)35-16-13-30-27(35)28(36)34-14-11-23(12-15-34)32-26-6-4-3-5-25(26)29/h3-10,13,16,20-21,23,31-32H,11-12,14-15,17-19H2,1-2H3/t20-,21+