5-(4-butoxyphenyl)-3-[(4-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-(4-butoxyphenyl)-3-[(4-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-(4-butoxyphenyl)-3-[(4-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-(4-butoxyphenyl)-3-[(4-methoxyphenyl)methylthio]-1H-1,2,4-triazole IUPAC Name: 5-(4-butoxyphenyl)-3-[(4-methoxyphenyl)methylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-(4-butoxyphenyl)-3-(p-anisylthio)-1H-1,2,4-triazole Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC=C(C=C3)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NC(=NN2)SCC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H23N3O2S/c1-3-4-13-25-18-11-7-16(8-12-18)19-21-20(23-22-19)26-14-15-5-9-17(24-2)10-6-15/h5-12H,3-4,13-14H2,1-2H3,(H,21,22,23)