4-(furan-2-ylmethyl)-3-(oxan-2-ylmethylsulfanyl)-5-thiophen-2-yl-1,2,4-triazole

Systemtic Name: 4-(furan-2-ylmethyl)-3-(oxan-2-ylmethylsulfanyl)-5-thiophen-2-yl-1,2,4-triazole Openeye Name: 4-(2-furylmethyl)-3-(tetrahydropyran-2-ylmethylsulfanyl)-5-(2-thienyl)-1,2,4-triazole CAS Name: 4-(2-furanylmethyl)-3-(2-oxanylmethylthio)-5-thiophen-2-yl-1,2,4-triazole IUPAC Name: 4-(furan-2-ylmethyl)-3-(oxan-2-ylmethylsulfanyl)-5-thiophen-2-yl-1,2,4-triazole Traditional Name: 4-(2-furfuryl)-3-(tetrahydropyran-2-ylmethylthio)-5-(2-thienyl)-1,2,4-triazole Formula: C17H19N3O2S2 MolecularWeight: 361.48166

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CS4

Isomeric SMILES

C1CCOC(C1)CSC2=NN=C(N2CC3=CC=CO3)C4=CC=CS4

InChI

InChI=1S/C17H19N3O2S2/c1-2-8-22-14(5-1)12-24-17-19-18-16(15-7-4-10-23-15)20(17)11-13-6-3-9-21-13/h3-4,6-7,9-10,14H,1-2,5,8,11-12H2