(E)-3-phenyl-N-[5-(pyrazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]prop-2-en-1-imine

Systemtic Name: (E)-3-phenyl-N-[5-(pyrazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]prop-2-en-1-imine Openeye Name: (E)-3-phenyl-N-[5-(pyrazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]prop-2-en-1-imine CAS Name: (E)-3-phenyl-N-[5-(1-pyrazolylmethyl)-1,3,4-thiadiazol-2-yl]-2-propen-1-imine IUPAC Name: (E)-3-phenyl-N-[5-(pyrazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]prop-2-en-1-imine Traditional Name: (E)-[(E)-3-phenylprop-2-enylidene]-[5-(pyrazol-1-ylmethyl)-1,3,4-thiadiazol-2-yl]amine Formula: C15H13N5S MolecularWeight: 295.36222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC=NC2=NN=C(S2)CN3C=CC=N3

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C=N/C2=NN=C(S2)CN3C=CC=N3

InChI

InChI=1S/C15H13N5S/c1-2-6-13(7-3-1)8-4-9-16-15-19-18-14(21-15)12-20-11-5-10-17-20/h1-11H,12H2/b8-4+,16-9+