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

Systemtic Name: 4-(furan-2-ylmethyl)-3-(3-methoxyphenyl)-5-(3-methylbut-2-enylsulfanyl)-1,2,4-triazole Openeye Name: 4-(2-furylmethyl)-3-(3-methoxyphenyl)-5-(3-methylbut-2-enylsulfanyl)-1,2,4-triazole CAS Name: 4-(2-furanylmethyl)-3-(3-methoxyphenyl)-5-(3-methylbut-2-enylthio)-1,2,4-triazole IUPAC Name: 4-(furan-2-ylmethyl)-3-(3-methoxyphenyl)-5-(3-methylbut-2-enylsulfanyl)-1,2,4-triazole Traditional Name: 4-(2-furfuryl)-3-(3-methoxyphenyl)-5-(3-methylbut-2-enylthio)-1,2,4-triazole Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCSC1=NN=C(N1CC2=CC=CO2)C3=CC(=CC=C3)OC)C

Isomeric SMILES

CC(=CCSC1=NN=C(N1CC2=CC=CO2)C3=CC(=CC=C3)OC)C

InChI

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