3-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-5-(furan-2-yl)-4-methyl-1,2,4-triazole

Systemtic Name: 3-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-5-(furan-2-yl)-4-methyl-1,2,4-triazole Openeye Name: 3-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-5-(2-furyl)-4-methyl-1,2,4-triazole CAS Name: 3-[[(4R)-1,3-dioxan-4-yl]methylthio]-5-(2-furanyl)-4-methyl-1,2,4-triazole IUPAC Name: 3-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-5-(furan-2-yl)-4-methyl-1,2,4-triazole Traditional Name: 3-[[(4R)-1,3-dioxan-4-yl]methylthio]-5-(2-furyl)-4-methyl-1,2,4-triazole Formula: C12H15N3O3S MolecularWeight: 281.3308

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2CCOCO2)C3=CC=CO3

Isomeric SMILES

CN1C(=NN=C1SC[C@H]2CCOCO2)C3=CC=CO3

InChI

InChI=1S/C12H15N3O3S/c1-15-11(10-3-2-5-17-10)13-14-12(15)19-7-9-4-6-16-8-18-9/h2-3,5,9H,4,6-8H2,1H3/t9-/m1/s1