1-[[5-[(3-methylphenyl)amino]-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]-N-pyridin-2-yl-piperidine-4-carboxamide

Systemtic Name: 1-[[5-[(3-methylphenyl)amino]-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]-N-pyridin-2-yl-piperidine-4-carboxamide Openeye Name: 1-[[5-(3-methylanilino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]-N-(2-pyridyl)piperidine-4-carboxamide CAS Name: 1-[[5-(3-methylanilino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]-N-(2-pyridinyl)-4-piperidinecarboxamide IUPAC Name: 1-[[5-(3-methylanilino)-2-sulfanylidene-1,3,4-thiadiazol-3-yl]methyl]-N-pyridin-2-ylpiperidine-4-carboxamide Traditional Name: 1-[[5-(m-toluidino)-2-thioxo-1,3,4-thiadiazol-3-yl]methyl]-N-(2-pyridyl)isonipecotamide Formula: C21H24N6OS2 MolecularWeight: 440.58486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NN(C(=S)S2)CN3CCC(CC3)C(=O)NC4=CC=CC=N4

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NN(C(=S)S2)CN3CCC(CC3)C(=O)NC4=CC=CC=N4

InChI

InChI=1S/C21H24N6OS2/c1-15-5-4-6-17(13-15)23-20-25-27(21(29)30-20)14-26-11-8-16(9-12-26)19(28)24-18-7-2-3-10-22-18/h2-7,10,13,16H,8-9,11-12,14H2,1H3,(H,23,25)(H,22,24,28)