1-(3-isothiocyanatopropyl)-3-(1-methylpyrazol-4-yl)pyrazole

Systemtic Name: 1-(3-isothiocyanatopropyl)-3-(1-methylpyrazol-4-yl)pyrazole Openeye Name: 1-(3-isothiocyanatopropyl)-3-(1-methylpyrazol-4-yl)pyrazole CAS Name: 1-(3-isothiocyanatopropyl)-3-(1-methyl-4-pyrazolyl)pyrazole IUPAC Name: 1-(3-isothiocyanatopropyl)-3-(1-methylpyrazol-4-yl)pyrazole Traditional Name: 1-(3-isothiocyanatopropyl)-3-(1-methylpyrazol-4-yl)pyrazole Formula: C11H13N5S MolecularWeight: 247.31942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N5S/c1-15-8-10(7-13-15)11-3-6-16(14-11)5-2-4-12-9-17/h3,6-8H,2,4-5H2,1H3