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

Systemtic Name: 3-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-5-thiophen-2-yl-1H-1,2,4-triazole Openeye Name: 3-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-5-(2-thienyl)-1H-1,2,4-triazole CAS Name: 3-[[(4R)-1,3-dioxan-4-yl]methylthio]-5-thiophen-2-yl-1H-1,2,4-triazole IUPAC Name: 3-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-5-thiophen-2-yl-1H-1,2,4-triazole Traditional Name: 3-[[(4R)-1,3-dioxan-4-yl]methylthio]-5-(2-thienyl)-1H-1,2,4-triazole Formula: C11H13N3O2S2 MolecularWeight: 283.36982

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Descriptors Computed from Structure

Canonical SMILES:

C1COCOC1CSC2=NNC(=N2)C3=CC=CS3

Isomeric SMILES

C1COCO[C@H]1CSC2=NNC(=N2)C3=CC=CS3

InChI

InChI=1S/C11H13N3O2S2/c1-2-9(17-5-1)10-12-11(14-13-10)18-6-8-3-4-15-7-16-8/h1-2,5,8H,3-4,6-7H2,(H,12,13,14)/t8-/m1/s1