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

Systemtic Name: 3-butan-2-ylsulfanyl-5-[(4-methoxyphenyl)methyl]-4-propyl-1,2,4-triazole Openeye Name: 3-[(4-methoxyphenyl)methyl]-4-propyl-5-sec-butylsulfanyl-1,2,4-triazole CAS Name: 3-(butan-2-ylthio)-5-[(4-methoxyphenyl)methyl]-4-propyl-1,2,4-triazole IUPAC Name: 3-butan-2-ylsulfanyl-5-[(4-methoxyphenyl)methyl]-4-propyl-1,2,4-triazole Traditional Name: 3-p-anisyl-4-propyl-5-(sec-butylthio)-1,2,4-triazole Formula: C17H25N3OS MolecularWeight: 319.4649

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SC(C)CC)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCCN1C(=NN=C1SC(C)CC)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H25N3OS/c1-5-11-20-16(18-19-17(20)22-13(3)6-2)12-14-7-9-15(21-4)10-8-14/h7-10,13H,5-6,11-12H2,1-4H3