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

Systemtic Name: N-butyl-5-(4-chloranyl-1,5-dimethyl-pyrazol-3-yl)-1,3,4-thiadiazol-2-amine; sulfuric acid Openeye Name: N-butyl-5-(4-chloro-1,5-dimethyl-pyrazol-3-yl)-1,3,4-thiadiazol-2-amine; sulfuric acid CAS Name: N-butyl-5-(4-chloro-1,5-dimethyl-3-pyrazolyl)-1,3,4-thiadiazol-2-amine; sulfuric acid IUPAC Name: N-butyl-5-(4-chloro-1,5-dimethylpyrazol-3-yl)-1,3,4-thiadiazol-2-amine; sulfuric acid Traditional Name: butyl-[5-(4-chloro-1,5-dimethyl-pyrazol-3-yl)-1,3,4-thiadiazol-2-yl]amine; sulfuric acid Formula: C11H18ClN5O4S2 MolecularWeight: 383.87472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NN=C(S1)C2=NN(C(=C2Cl)C)C.OS(=O)(=O)O

Isomeric SMILES

CCCCNC1=NN=C(S1)C2=NN(C(=C2Cl)C)C.OS(=O)(=O)O

InChI

InChI=1S/C11H16ClN5S.H2O4S/c1-4-5-6-13-11-15-14-10(18-11)9-8(12)7(2)17(3)16-9;1-5(2,3)4/h4-6H2,1-3H3,(H,13,15);(H2,1,2,3,4)