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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NN=C(S2)C3=NN(C=C3Cl)C.OS(=O)(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NN=C(S2)C3=NN(C=C3Cl)C.OS(=O)(=O)O

InChI

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