2-[[4-ethyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-piperidin-1-ylisoquinolin-8-yl)ethanamide

Systemtic Name: 2-[[4-ethyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-piperidin-1-ylisoquinolin-8-yl)ethanamide Openeye Name: 2-[[4-ethyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[5-(1-piperidyl)-8-isoquinolyl]acetamide CAS Name: 2-[[4-ethyl-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]-N-[5-(1-piperidinyl)-8-isoquinolinyl]acetamide IUPAC Name: 2-[[4-ethyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-(5-piperidin-1-ylisoquinolin-8-yl)acetamide Traditional Name: 2-[[4-ethyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]-N-(5-piperidino-8-isoquinolyl)acetamide Formula: C24H26N6O2S MolecularWeight: 462.56724

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4)C5=CC=CO5

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=C3C=NC=CC3=C(C=C2)N4CCCCC4)C5=CC=CO5

InChI

InChI=1S/C24H26N6O2S/c1-2-30-23(21-7-6-14-32-21)27-28-24(30)33-16-22(31)26-19-8-9-20(29-12-4-3-5-13-29)17-10-11-25-15-18(17)19/h6-11,14-15H,2-5,12-13,16H2,1H3,(H,26,31)