5-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethyl]-N-butyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[2-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)ethyl]-N-butyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)ethyl]-N-butyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[2-(4-bromo-3,5-dimethyl-1-pyrazolyl)ethyl]-N-butyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[2-(4-bromo-3,5-dimethylpyrazol-1-yl)ethyl]-N-butyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-[2-(4-bromo-3,5-dimethyl-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-yl]-butyl-amine Formula: C13H20BrN5S MolecularWeight: 358.3004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NN=C(S1)CCN2C(=C(C(=N2)C)Br)C

Isomeric SMILES

CCCCNC1=NN=C(S1)CCN2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C13H20BrN5S/c1-4-5-7-15-13-17-16-11(20-13)6-8-19-10(3)12(14)9(2)18-19/h4-8H2,1-3H3,(H,15,17)