5-(4-chloranyl-1-methyl-pyrazol-3-yl)-4-(furan-2-ylmethyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(4-chloranyl-1-methyl-pyrazol-3-yl)-4-(furan-2-ylmethyl)-1,2,4-triazole-3-thiolate Openeye Name: 5-(4-chloro-1-methyl-pyrazol-3-yl)-4-(2-furylmethyl)-1,2,4-triazole-3-thiolate CAS Name: 5-(4-chloro-1-methyl-3-pyrazolyl)-4-(2-furanylmethyl)-1,2,4-triazole-3-thiolate IUPAC Name: 5-(4-chloro-1-methylpyrazol-3-yl)-4-(furan-2-ylmethyl)-1,2,4-triazole-3-thiolate Traditional Name: 5-(4-chloro-1-methyl-pyrazol-3-yl)-4-(2-furfuryl)-1,2,4-triazole-3-thiolate Formula: C11H9ClN5OS- MolecularWeight: 294.74006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=NN=C(N2CC3=CC=CO3)[S-])Cl

Isomeric SMILES

CN1C=C(C(=N1)C2=NN=C(N2CC3=CC=CO3)[S-])Cl

InChI

InChI=1S/C11H10ClN5OS/c1-16-6-8(12)9(15-16)10-13-14-11(19)17(10)5-7-3-2-4-18-7/h2-4,6H,5H2,1H3,(H,14,19)/p-1