4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-N-phenyl-piperazine-1-carboxamide

Systemtic Name: 4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-N-phenyl-piperazine-1-carboxamide Openeye Name: 4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-N-phenyl-piperazine-1-carboxamide CAS Name: 4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-N-phenyl-1-piperazinecarboxamide IUPAC Name: 4-[3-[(4-fluorophenyl)methyl]-1,2,4-thiadiazol-5-yl]-2-methyl-N-phenylpiperazine-1-carboxamide Traditional Name: 4-[3-(4-fluorobenzyl)-1,2,4-thiadiazol-5-yl]-2-methyl-N-phenyl-piperazine-1-carboxamide Formula: C21H22FN5OS MolecularWeight: 411.495683

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)NC2=CC=CC=C2)C3=NC(=NS3)CC4=CC=C(C=C4)F

Isomeric SMILES

CC1CN(CCN1C(=O)NC2=CC=CC=C2)C3=NC(=NS3)CC4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FN5OS/c1-15-14-26(11-12-27(15)20(28)23-18-5-3-2-4-6-18)21-24-19(25-29-21)13-16-7-9-17(22)10-8-16/h2-10,15H,11-14H2,1H3,(H,23,28)