3-[4-(furan-2-ylmethyl)-5-(oxan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-(furan-2-ylmethyl)-5-(oxan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-(2-furylmethyl)-5-(tetrahydropyran-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-(2-furanylmethyl)-5-(2-oxanylmethylthio)-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-(furan-2-ylmethyl)-5-(oxan-2-ylmethylsulfanyl)-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-(2-furfuryl)-5-(tetrahydropyran-2-ylmethylthio)-1,2,4-triazol-3-yl]propionamide Formula: C16H22N4O3S MolecularWeight: 350.43588

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CSC2=NN=C(N2CC3=CC=CO3)CCC(=O)N

Isomeric SMILES

C1CCOC(C1)CSC2=NN=C(N2CC3=CC=CO3)CCC(=O)N

InChI

InChI=1S/C16H22N4O3S/c17-14(21)6-7-15-18-19-16(20(15)10-12-5-3-9-22-12)24-11-13-4-1-2-8-23-13/h3,5,9,13H,1-2,4,6-8,10-11H2,(H2,17,21)