3-(2-methoxyphenyl)-4-methyl-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-(2-methoxyphenyl)-4-methyl-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(2-methoxyphenyl)-4-methyl-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-(2-methoxyphenyl)-4-methyl-5-[[4-(1-pyrazolyl)phenyl]methylthio]-1,2,4-triazole IUPAC Name: 3-(2-methoxyphenyl)-4-methyl-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(2-methoxyphenyl)-4-methyl-5-[(4-pyrazol-1-ylbenzyl)thio]-1,2,4-triazole Formula: C20H19N5OS MolecularWeight: 377.46276

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=C(C=C2)N3C=CC=N3)C4=CC=CC=C4OC

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=C(C=C2)N3C=CC=N3)C4=CC=CC=C4OC

InChI

InChI=1S/C20H19N5OS/c1-24-19(17-6-3-4-7-18(17)26-2)22-23-20(24)27-14-15-8-10-16(11-9-15)25-13-5-12-21-25/h3-13H,14H2,1-2H3