3-(2,5-dimethylpyrazol-3-yl)-4-(furan-2-ylmethyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(2,5-dimethylpyrazol-3-yl)-4-(furan-2-ylmethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-(2,5-dimethylpyrazol-3-yl)-4-(2-furylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(2,5-dimethyl-3-pyrazolyl)-4-(2-furanylmethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(2,5-dimethylpyrazol-3-yl)-4-(furan-2-ylmethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-(2,5-dimethylpyrazol-3-yl)-4-(2-furfuryl)-1H-1,2,4-triazole-5-thione Formula: C12H13N5OS MolecularWeight: 275.32952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C2=NNC(=S)N2CC3=CC=CO3)C

Isomeric SMILES

CC1=NN(C(=C1)C2=NNC(=S)N2CC3=CC=CO3)C

InChI

InChI=1S/C12H13N5OS/c1-8-6-10(16(2)15-8)11-13-14-12(19)17(11)7-9-4-3-5-18-9/h3-6H,7H2,1-2H3,(H,14,19)