3-butan-2-ylsulfanyl-4-(2-methoxyethyl)-5-[(4-methoxyphenyl)methyl]-1,2,4-triazole

Systemtic Name: 3-butan-2-ylsulfanyl-4-(2-methoxyethyl)-5-[(4-methoxyphenyl)methyl]-1,2,4-triazole Openeye Name: 4-(2-methoxyethyl)-3-[(4-methoxyphenyl)methyl]-5-sec-butylsulfanyl-1,2,4-triazole CAS Name: 3-(butan-2-ylthio)-4-(2-methoxyethyl)-5-[(4-methoxyphenyl)methyl]-1,2,4-triazole IUPAC Name: 3-butan-2-ylsulfanyl-4-(2-methoxyethyl)-5-[(4-methoxyphenyl)methyl]-1,2,4-triazole Traditional Name: 4-(2-methoxyethyl)-3-p-anisyl-5-(sec-butylthio)-1,2,4-triazole Formula: C17H25N3O2S MolecularWeight: 335.4643

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NN=C(N1CCOC)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCC(C)SC1=NN=C(N1CCOC)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H25N3O2S/c1-5-13(2)23-17-19-18-16(20(17)10-11-21-3)12-14-6-8-15(22-4)9-7-14/h6-9,13H,5,10-12H2,1-4H3