3-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-5-(3-methylbutylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-5-(3-methylbutylsulfanyl)-1,2,4-triazole Openeye Name: 3-isopentylsulfanyl-5-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-1,2,4-triazole CAS Name: 3-(3-methoxy-1-methyl-4-pyrazolyl)-4-methyl-5-(3-methylbutylthio)-1,2,4-triazole IUPAC Name: 3-(3-methoxy-1-methylpyrazol-4-yl)-4-methyl-5-(3-methylbutylsulfanyl)-1,2,4-triazole Traditional Name: 3-(isoamylthio)-5-(3-methoxy-1-methyl-pyrazol-4-yl)-4-methyl-1,2,4-triazole Formula: C13H21N5OS MolecularWeight: 295.40374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NN=C(N1C)C2=CN(N=C2OC)C

Isomeric SMILES

CC(C)CCSC1=NN=C(N1C)C2=CN(N=C2OC)C

InChI

InChI=1S/C13H21N5OS/c1-9(2)6-7-20-13-15-14-11(18(13)4)10-8-17(3)16-12(10)19-5/h8-9H,6-7H2,1-5H3