3-(methoxymethyl)-5-(3-methylbutylsulfanyl)-4-phenyl-1,2,4-triazole

Systemtic Name: 3-(methoxymethyl)-5-(3-methylbutylsulfanyl)-4-phenyl-1,2,4-triazole Openeye Name: 3-isopentylsulfanyl-5-(methoxymethyl)-4-phenyl-1,2,4-triazole CAS Name: 3-(methoxymethyl)-5-(3-methylbutylthio)-4-phenyl-1,2,4-triazole IUPAC Name: 3-(methoxymethyl)-5-(3-methylbutylsulfanyl)-4-phenyl-1,2,4-triazole Traditional Name: 3-(isoamylthio)-5-(methoxymethyl)-4-phenyl-1,2,4-triazole Formula: C15H21N3OS MolecularWeight: 291.41174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NN=C(N1C2=CC=CC=C2)COC

Isomeric SMILES

CC(C)CCSC1=NN=C(N1C2=CC=CC=C2)COC

InChI

InChI=1S/C15H21N3OS/c1-12(2)9-10-20-15-17-16-14(11-19-3)18(15)13-7-5-4-6-8-13/h4-8,12H,9-11H2,1-3H3