4-ethyl-3-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylsulfanyl]-1,2,4-triazole

Systemtic Name: 4-ethyl-3-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylsulfanyl]-1,2,4-triazole Openeye Name: 4-ethyl-3-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylsulfanyl]-1,2,4-triazole CAS Name: 4-ethyl-3-[[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]methylthio]-1,2,4-triazole IUPAC Name: 4-ethyl-3-[[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]methylsulfanyl]-1,2,4-triazole Traditional Name: 4-ethyl-3-[[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methylthio]-1,2,4-triazole Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN=C1SCC2=CN(N=C2C3=CC=C(C=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CCN1C=NN=C1SCC2=CN(N=C2C3=CC=C(C=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5OS/c1-3-25-15-22-23-21(25)28-14-17-13-26(18-7-5-4-6-8-18)24-20(17)16-9-11-19(27-2)12-10-16/h4-13,15H,3,14H2,1-2H3