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

Systemtic Name: 3-(4-chloranyl-1,5-dimethyl-pyrazol-3-yl)-4-(furan-2-ylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(4-chloro-1,5-dimethyl-pyrazol-3-yl)-4-(2-furylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(4-chloro-1,5-dimethyl-3-pyrazolyl)-4-(2-furanylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(4-chloro-1,5-dimethylpyrazol-3-yl)-4-(furan-2-ylmethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(4-chloro-1,5-dimethyl-pyrazol-3-yl)-4-(2-furfuryl)-1H-1,2,4-triazole-5-thione Formula: C12H12ClN5OS MolecularWeight: 309.77458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C2=NNC(=S)N2CC3=CC=CO3)Cl

Isomeric SMILES

CC1=C(C(=NN1C)C2=NNC(=S)N2CC3=CC=CO3)Cl

InChI

InChI=1S/C12H12ClN5OS/c1-7-9(13)10(16-17(7)2)11-14-15-12(20)18(11)6-8-4-3-5-19-8/h3-5H,6H2,1-2H3,(H,15,20)