2-[[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-methyl-amino]-1-[4-(phenylmethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-methyl-amino]-1-[4-(phenylmethyl)piperazin-1-yl]ethanone Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-[[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-methyl-amino]ethanone CAS Name: 2-[[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-methylamino]-1-[4-(phenylmethyl)-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-[[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-methylamino]ethanone Traditional Name: 1-(4-benzylpiperazino)-2-[[3-(4-fluorobenzyl)-1,2,4-thiadiazol-5-yl]-methyl-amino]ethanone Formula: C23H26FN5OS MolecularWeight: 439.548843

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCN(CC1)CC2=CC=CC=C2)C3=NC(=NS3)CC4=CC=C(C=C4)F

Isomeric SMILES

CN(CC(=O)N1CCN(CC1)CC2=CC=CC=C2)C3=NC(=NS3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C23H26FN5OS/c1-27(23-25-21(26-31-23)15-18-7-9-20(24)10-8-18)17-22(30)29-13-11-28(12-14-29)16-19-5-3-2-4-6-19/h2-10H,11-17H2,1H3