1-ethyl-4-[1-(3-isothiocyanatopropyl)pyrazol-3-yl]-3-methyl-pyrazole

Systemtic Name: 1-ethyl-4-[1-(3-isothiocyanatopropyl)pyrazol-3-yl]-3-methyl-pyrazole Openeye Name: 1-ethyl-4-[1-(3-isothiocyanatopropyl)pyrazol-3-yl]-3-methyl-pyrazole CAS Name: 1-ethyl-4-[1-(3-isothiocyanatopropyl)-3-pyrazolyl]-3-methylpyrazole IUPAC Name: 1-ethyl-4-[1-(3-isothiocyanatopropyl)pyrazol-3-yl]-3-methylpyrazole Traditional Name: 1-ethyl-4-[1-(3-isothiocyanatopropyl)pyrazol-3-yl]-3-methyl-pyrazole Formula: C13H17N5S MolecularWeight: 275.37258

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C2=NN(C=C2)CCCN=C=S

Isomeric SMILES

CCN1C=C(C(=N1)C)C2=NN(C=C2)CCCN=C=S

InChI

InChI=1S/C13H17N5S/c1-3-17-9-12(11(2)15-17)13-5-8-18(16-13)7-4-6-14-10-19/h5,8-9H,3-4,6-7H2,1-2H3