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

Systemtic Name: N-(3-cyanophenyl)-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperazine-1-carboxamide Openeye Name: N-(3-cyanophenyl)-4-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]piperazine-1-carboxamide CAS Name: N-(3-cyanophenyl)-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-1-piperazinecarboxamide IUPAC Name: N-(3-cyanophenyl)-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]piperazine-1-carboxamide Traditional Name: N-(3-cyanophenyl)-4-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]piperazine-1-carboxamide Formula: C22H22N6OS MolecularWeight: 418.51468

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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(=C4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)CC2=NSC(=N2)N3CCN(CC3)C(=O)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C22H22N6OS/c1-16-5-7-17(8-6-16)14-20-25-22(30-26-20)28-11-9-27(10-12-28)21(29)24-19-4-2-3-18(13-19)15-23/h2-8,13H,9-12,14H2,1H3,(H,24,29)