1-(2-isothiocyanatoethyl)-3-(1-methylpyrazol-4-yl)pyrazole

Systemtic Name: 1-(2-isothiocyanatoethyl)-3-(1-methylpyrazol-4-yl)pyrazole Openeye Name: 1-(2-isothiocyanatoethyl)-3-(1-methylpyrazol-4-yl)pyrazole CAS Name: 1-(2-isothiocyanatoethyl)-3-(1-methyl-4-pyrazolyl)pyrazole IUPAC Name: 1-(2-isothiocyanatoethyl)-3-(1-methylpyrazol-4-yl)pyrazole Traditional Name: 1-(2-isothiocyanatoethyl)-3-(1-methylpyrazol-4-yl)pyrazole Formula: C10H11N5S MolecularWeight: 233.29284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=NN(C=C2)CCN=C=S

Isomeric SMILES

CN1C=C(C=N1)C2=NN(C=C2)CCN=C=S

InChI

InChI=1S/C10H11N5S/c1-14-7-9(6-12-14)10-2-4-15(13-10)5-3-11-8-16/h2,4,6-7H,3,5H2,1H3