1-[4-[1-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidin-3-yl]carbonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-[1-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidin-3-yl]carbonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-[1-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-3-carbonyl]piperazin-1-yl]ethanone CAS Name: 1-[4-[[1-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-3-piperidinyl]-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[1-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]piperidine-3-carbonyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[1-[3-(4-fluorobenzyl)-1,2,4-thiadiazol-5-yl]nipecotoyl]piperazino]ethanone Formula: C21H26FN5O2S MolecularWeight: 431.526843

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2CCCN(C2)C3=NC(=NS3)CC4=CC=C(C=C4)F

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2CCCN(C2)C3=NC(=NS3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C21H26FN5O2S/c1-15(28)25-9-11-26(12-10-25)20(29)17-3-2-8-27(14-17)21-23-19(24-30-21)13-16-4-6-18(22)7-5-16/h4-7,17H,2-3,8-14H2,1H3