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

Systemtic Name: 2-methyl-N-(2-methylphenyl)-4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]piperazine-1-carboxamide Openeye Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-2-methyl-N-(o-tolyl)piperazine-1-carboxamide CAS Name: 2-methyl-N-(2-methylphenyl)-4-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-1-piperazinecarboxamide IUPAC Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-2-methyl-N-(2-methylphenyl)piperazine-1-carboxamide Traditional Name: 4-(3-benzyl-1,2,4-thiadiazol-5-yl)-2-methyl-N-(o-tolyl)piperazine-1-carboxamide Formula: C22H25N5OS MolecularWeight: 407.5318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)NC2=CC=CC=C2C)C3=NC(=NS3)CC4=CC=CC=C4

Isomeric SMILES

CC1CN(CCN1C(=O)NC2=CC=CC=C2C)C3=NC(=NS3)CC4=CC=CC=C4

InChI

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