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

Systemtic Name: 4-(furan-2-ylmethyl)-3-(4-methoxyphenyl)-5-(3-phenylprop-2-enylsulfanyl)-1,2,4-triazole Openeye Name: 3-cinnamylsulfanyl-4-(2-furylmethyl)-5-(4-methoxyphenyl)-1,2,4-triazole CAS Name: 4-(2-furanylmethyl)-3-(4-methoxyphenyl)-5-(3-phenylprop-2-enylthio)-1,2,4-triazole IUPAC Name: 4-(furan-2-ylmethyl)-3-(4-methoxyphenyl)-5-(3-phenylprop-2-enylsulfanyl)-1,2,4-triazole Traditional Name: 3-(cinnamylthio)-4-(2-furfuryl)-5-(4-methoxyphenyl)-1,2,4-triazole Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2CC3=CC=CO3)SCC=CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2CC3=CC=CO3)SCC=CC4=CC=CC=C4

InChI

InChI=1S/C23H21N3O2S/c1-27-20-13-11-19(12-14-20)22-24-25-23(26(22)17-21-10-5-15-28-21)29-16-6-9-18-7-3-2-4-8-18/h2-15H,16-17H2,1H3