3-[3-(furan-2-yl)-5-(2-pyridin-4-ylethylsulfanyl)-1,2,4-triazol-4-yl]propanamide

Systemtic Name: 3-[3-(furan-2-yl)-5-(2-pyridin-4-ylethylsulfanyl)-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-(2-furyl)-5-[2-(4-pyridyl)ethylsulfanyl]-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-(2-furanyl)-5-(2-pyridin-4-ylethylthio)-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-(furan-2-yl)-5-(2-pyridin-4-ylethylsulfanyl)-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-(2-furyl)-5-[2-(4-pyridyl)ethylthio]-1,2,4-triazol-4-yl]propionamide Formula: C16H17N5O2S MolecularWeight: 343.40348

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=NN=C(N2CCC(=O)N)SCCC3=CC=NC=C3

Isomeric SMILES

C1=COC(=C1)C2=NN=C(N2CCC(=O)N)SCCC3=CC=NC=C3

InChI

InChI=1S/C16H17N5O2S/c17-14(22)5-9-21-15(13-2-1-10-23-13)19-20-16(21)24-11-6-12-3-7-18-8-4-12/h1-4,7-8,10H,5-6,9,11H2,(H2,17,22)