2-(4-chloranyl-5-ethyl-2-methyl-pyrazol-3-yl)-5-pentylsulfanyl-1,3,4-thiadiazole

Systemtic Name: 2-(4-chloranyl-5-ethyl-2-methyl-pyrazol-3-yl)-5-pentylsulfanyl-1,3,4-thiadiazole Openeye Name: 2-(4-chloro-5-ethyl-2-methyl-pyrazol-3-yl)-5-pentylsulfanyl-1,3,4-thiadiazole CAS Name: 2-(4-chloro-5-ethyl-2-methyl-3-pyrazolyl)-5-(pentylthio)-1,3,4-thiadiazole IUPAC Name: 2-(4-chloro-5-ethyl-2-methylpyrazol-3-yl)-5-pentylsulfanyl-1,3,4-thiadiazole Traditional Name: 2-(amylthio)-5-(4-chloro-5-ethyl-2-methyl-pyrazol-3-yl)-1,3,4-thiadiazole Formula: C13H19ClN4S2 MolecularWeight: 330.89976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NN=C(S1)C2=C(C(=NN2C)CC)Cl

Isomeric SMILES

CCCCCSC1=NN=C(S1)C2=C(C(=NN2C)CC)Cl

InChI

InChI=1S/C13H19ClN4S2/c1-4-6-7-8-19-13-16-15-12(20-13)11-10(14)9(5-2)17-18(11)3/h4-8H2,1-3H3