4-(furan-2-ylmethyl)-3-(3-methoxyphenyl)-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-(furan-2-ylmethyl)-3-(3-methoxyphenyl)-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazole Openeye Name: 4-(2-furylmethyl)-3-(3-methoxyphenyl)-5-(2-methylallylsulfanyl)-1,2,4-triazole CAS Name: 4-(2-furanylmethyl)-3-(3-methoxyphenyl)-5-(2-methylprop-2-enylthio)-1,2,4-triazole IUPAC Name: 4-(furan-2-ylmethyl)-3-(3-methoxyphenyl)-5-(2-methylprop-2-enylsulfanyl)-1,2,4-triazole Traditional Name: 4-(2-furfuryl)-3-(3-methoxyphenyl)-5-(2-methylallylthio)-1,2,4-triazole Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1=NN=C(N1CC2=CC=CO2)C3=CC(=CC=C3)OC

Isomeric SMILES

CC(=C)CSC1=NN=C(N1CC2=CC=CO2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C18H19N3O2S/c1-13(2)12-24-18-20-19-17(14-6-4-7-15(10-14)22-3)21(18)11-16-8-5-9-23-16/h4-10H,1,11-12H2,2-3H3