3-(4-methoxyphenyl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(4-methoxyphenyl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(4-methoxyphenyl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(4-methoxyphenyl)-5-[[4-(1-pyrazolyl)phenyl]methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(4-methoxyphenyl)-5-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(4-methoxyphenyl)-5-[(4-pyrazol-1-ylbenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C19H18N6OS MolecularWeight: 378.45082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2N)SCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2N)SCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C19H18N6OS/c1-26-17-9-5-15(6-10-17)18-22-23-19(25(18)20)27-13-14-3-7-16(8-4-14)24-12-2-11-21-24/h2-12H,13,20H2,1H3