(3Z)-1-(piperidin-1-ylmethyl)-3-[(3-pyridin-4-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)imino]indol-2-one

Systemtic Name: (3Z)-1-(piperidin-1-ylmethyl)-3-[(3-pyridin-4-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)imino]indol-2-one Openeye Name: (3Z)-1-(1-piperidylmethyl)-3-[[3-(4-pyridyl)-5-thioxo-1H-1,2,4-triazol-4-yl]imino]indolin-2-one CAS Name: (3Z)-1-(1-piperidinylmethyl)-3-[(3-pyridin-4-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)imino]-2-indolone IUPAC Name: (3Z)-1-(piperidin-1-ylmethyl)-3-[(3-pyridin-4-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)imino]indol-2-one Traditional Name: (3Z)-1-(piperidinomethyl)-3-[[3-(4-pyridyl)-5-thioxo-1H-1,2,4-triazol-4-yl]imino]oxindole Formula: C21H21N7OS MolecularWeight: 419.50274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CN2C3=CC=CC=C3C(=NN4C(=NNC4=S)C5=CC=NC=C5)C2=O

Isomeric SMILES

C1CCN(CC1)CN2C3=CC=CC=C3/C(=N/N4C(=NNC4=S)C5=CC=NC=C5)/C2=O

InChI

InChI=1S/C21H21N7OS/c29-20-18(25-28-19(23-24-21(28)30)15-8-10-22-11-9-15)16-6-2-3-7-17(16)27(20)14-26-12-4-1-5-13-26/h2-3,6-11H,1,4-5,12-14H2,(H,24,30)/b25-18-