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

Systemtic Name: 2-methyl-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-phenyl-piperazine-1-carboxamide Openeye Name: 2-methyl-N-phenyl-4-[3-(p-tolylmethyl)-1,2,4-thiadiazol-5-yl]piperazine-1-carboxamide CAS Name: 2-methyl-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-phenyl-1-piperazinecarboxamide IUPAC Name: 2-methyl-4-[3-[(4-methylphenyl)methyl]-1,2,4-thiadiazol-5-yl]-N-phenylpiperazine-1-carboxamide Traditional Name: 2-methyl-4-[3-(4-methylbenzyl)-1,2,4-thiadiazol-5-yl]-N-phenyl-piperazine-1-carboxamide Formula: C22H25N5OS MolecularWeight: 407.5318

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C22H25N5OS/c1-16-8-10-18(11-9-16)14-20-24-22(29-25-20)26-12-13-27(17(2)15-26)21(28)23-19-6-4-3-5-7-19/h3-11,17H,12-15H2,1-2H3,(H,23,28)