2-[4-[[4-ethyl-3-(furan-2-yl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-[[4-ethyl-3-(furan-2-yl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-[[4-ethyl-3-(2-furyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[[4-ethyl-3-(2-furanyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-[[4-ethyl-3-(furan-2-yl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-[[4-ethyl-3-(2-furyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazino]isonicotinonitrile Formula: C19H21N7OS MolecularWeight: 395.48134

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN2CCN(CC2)C3=NC=CC(=C3)C#N)C4=CC=CO4

Isomeric SMILES

CCN1C(=NN(C1=S)CN2CCN(CC2)C3=NC=CC(=C3)C#N)C4=CC=CO4

InChI

InChI=1S/C19H21N7OS/c1-2-25-18(16-4-3-11-27-16)22-26(19(25)28)14-23-7-9-24(10-8-23)17-12-15(13-20)5-6-21-17/h3-6,11-12H,2,7-10,14H2,1H3