N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: 2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)-N-[1-(p-tolylsulfonyl)-4-piperidyl]acetamide CAS Name: N-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: 2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)-N-(1-tosyl-4-piperidyl)acetamide Formula: C19H27N5O3S2 MolecularWeight: 437.57938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NC2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NC2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H27N5O3S2/c1-3-4-17-21-22-19(28)24(17)13-18(25)20-15-9-11-23(12-10-15)29(26,27)16-7-5-14(2)6-8-16/h5-8,15H,3-4,9-13H2,1-2H3,(H,20,25)(H,22,28)