3-ethyl-5-(3-methylbutylsulfanyl)-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-ethyl-5-(3-methylbutylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-ethyl-5-isopentylsulfanyl-1,2,4-triazole CAS Name: 3-ethyl-5-(3-methylbutylthio)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-ethyl-5-(3-methylbutylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-ethyl-5-(isoamylthio)-1,2,4-triazole Formula: C12H21N3S MolecularWeight: 239.38024

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1CC=C)SCCC(C)C

Isomeric SMILES

CCC1=NN=C(N1CC=C)SCCC(C)C

InChI

InChI=1S/C12H21N3S/c1-5-8-15-11(6-2)13-14-12(15)16-9-7-10(3)4/h5,10H,1,6-9H2,2-4H3