3-(furan-2-yl)-4-(4-methoxyphenyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-(furan-2-yl)-4-(4-methoxyphenyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(2-furyl)-4-(4-methoxyphenyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-(2-furanyl)-4-(4-methoxyphenyl)-5-[(3-methoxyphenyl)methylthio]-1,2,4-triazole IUPAC Name: 3-(furan-2-yl)-4-(4-methoxyphenyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(2-furyl)-5-(m-anisylthio)-4-(4-methoxyphenyl)-1,2,4-triazole Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=CC=C3)OC)C4=CC=CO4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=CC=C3)OC)C4=CC=CO4

InChI

InChI=1S/C21H19N3O3S/c1-25-17-10-8-16(9-11-17)24-20(19-7-4-12-27-19)22-23-21(24)28-14-15-5-3-6-18(13-15)26-2/h3-13H,14H2,1-2H3