5-(4-chloranyl-2,5-dimethyl-pyrazol-3-yl)-N-phenyl-1,3,4-thiadiazol-2-amine; sulfuric acid

Systemtic Name: 5-(4-chloranyl-2,5-dimethyl-pyrazol-3-yl)-N-phenyl-1,3,4-thiadiazol-2-amine; sulfuric acid Openeye Name: 5-(4-chloro-2,5-dimethyl-pyrazol-3-yl)-N-phenyl-1,3,4-thiadiazol-2-amine; sulfuric acid CAS Name: 5-(4-chloro-2,5-dimethyl-3-pyrazolyl)-N-phenyl-1,3,4-thiadiazol-2-amine; sulfuric acid IUPAC Name: 5-(4-chloro-2,5-dimethylpyrazol-3-yl)-N-phenyl-1,3,4-thiadiazol-2-amine; sulfuric acid Traditional Name: [5-(4-chloro-2,5-dimethyl-pyrazol-3-yl)-1,3,4-thiadiazol-2-yl]-phenyl-amine; sulfuric acid Formula: C13H14ClN5O4S2 MolecularWeight: 403.86436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1Cl)C2=NN=C(S2)NC3=CC=CC=C3)C.OS(=O)(=O)O

Isomeric SMILES

CC1=NN(C(=C1Cl)C2=NN=C(S2)NC3=CC=CC=C3)C.OS(=O)(=O)O

InChI

InChI=1S/C13H12ClN5S.H2O4S/c1-8-10(14)11(19(2)18-8)12-16-17-13(20-12)15-9-6-4-3-5-7-9;1-5(2,3)4/h3-7H,1-2H3,(H,15,17);(H2,1,2,3,4)