3-(4-chloranyl-2,5-dimethyl-pyrazol-3-yl)-4-(3-ethoxypropyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(4-chloranyl-2,5-dimethyl-pyrazol-3-yl)-4-(3-ethoxypropyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(4-chloro-2,5-dimethyl-pyrazol-3-yl)-4-(3-ethoxypropyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(4-chloro-2,5-dimethyl-3-pyrazolyl)-4-(3-ethoxypropyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(4-chloro-2,5-dimethylpyrazol-3-yl)-4-(3-ethoxypropyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(4-chloro-2,5-dimethyl-pyrazol-3-yl)-4-(3-ethoxypropyl)-1H-1,2,4-triazole-5-thione Formula: C12H18ClN5OS MolecularWeight: 315.82222

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=NNC1=S)C2=C(C(=NN2C)C)Cl

Isomeric SMILES

CCOCCCN1C(=NNC1=S)C2=C(C(=NN2C)C)Cl

InChI

InChI=1S/C12H18ClN5OS/c1-4-19-7-5-6-18-11(14-15-12(18)20)10-9(13)8(2)16-17(10)3/h4-7H2,1-3H3,(H,15,20)