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

Systemtic Name: 3-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-1,2,4-triazole Openeye Name: 3-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-4-(2-furylmethyl)-5-(3-methoxyphenyl)-1,2,4-triazole CAS Name: 3-[[(4R)-1,3-dioxan-4-yl]methylthio]-4-(2-furanylmethyl)-5-(3-methoxyphenyl)-1,2,4-triazole IUPAC Name: 3-[[(4R)-1,3-dioxan-4-yl]methylsulfanyl]-4-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-1,2,4-triazole Traditional Name: 3-[[(4R)-1,3-dioxan-4-yl]methylthio]-4-(2-furfuryl)-5-(3-methoxyphenyl)-1,2,4-triazole Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN=C(N2CC3=CC=CO3)SCC4CCOCO4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN=C(N2CC3=CC=CO3)SC[C@H]4CCOCO4

InChI

InChI=1S/C19H21N3O4S/c1-23-15-5-2-4-14(10-15)18-20-21-19(22(18)11-16-6-3-8-25-16)27-12-17-7-9-24-13-26-17/h2-6,8,10,17H,7,9,11-13H2,1H3/t17-/m1/s1