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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=NSC(=N2)N3CCN(CC3)C(=O)NC4=CC=CC=C4F

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NSC(=N2)N3CCN(CC3)C(=O)NC4=CC=CC=C4F

InChI

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