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

Systemtic Name: 3-(furan-2-yl)-4-(4-methylphenyl)-5-(oxan-2-ylmethylsulfanyl)-1,2,4-triazole Openeye Name: 3-(2-furyl)-4-(p-tolyl)-5-(tetrahydropyran-2-ylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-(2-furanyl)-4-(4-methylphenyl)-5-(2-oxanylmethylthio)-1,2,4-triazole IUPAC Name: 3-(furan-2-yl)-4-(4-methylphenyl)-5-(oxan-2-ylmethylsulfanyl)-1,2,4-triazole Traditional Name: 3-(2-furyl)-4-(p-tolyl)-5-(tetrahydropyran-2-ylmethylthio)-1,2,4-triazole Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3CCCCO3)C4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3CCCCO3)C4=CC=CO4

InChI

InChI=1S/C19H21N3O2S/c1-14-7-9-15(10-8-14)22-18(17-6-4-12-24-17)20-21-19(22)25-13-16-5-2-3-11-23-16/h4,6-10,12,16H,2-3,5,11,13H2,1H3