4-(2-methoxyphenyl)-3-phenyl-5-(4-phenylbutylsulfanyl)-1,2,4-triazole

Systemtic Name: 4-(2-methoxyphenyl)-3-phenyl-5-(4-phenylbutylsulfanyl)-1,2,4-triazole Openeye Name: 4-(2-methoxyphenyl)-3-phenyl-5-(4-phenylbutylsulfanyl)-1,2,4-triazole CAS Name: 4-(2-methoxyphenyl)-3-phenyl-5-(4-phenylbutylthio)-1,2,4-triazole IUPAC Name: 4-(2-methoxyphenyl)-3-phenyl-5-(4-phenylbutylsulfanyl)-1,2,4-triazole Traditional Name: 4-(2-methoxyphenyl)-3-phenyl-5-(4-phenylbutylthio)-1,2,4-triazole Formula: C25H25N3OS MolecularWeight: 415.5505

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=NN=C2SCCCCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1N2C(=NN=C2SCCCCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H25N3OS/c1-29-23-18-9-8-17-22(23)28-24(21-15-6-3-7-16-21)26-27-25(28)30-19-11-10-14-20-12-4-2-5-13-20/h2-9,12-13,15-18H,10-11,14,19H2,1H3