S-pyridin-2-yl 1-(4-chlorophenyl)-5-propyl-pyrazole-4-carbothioate

Systemtic Name: S-pyridin-2-yl 1-(4-chlorophenyl)-5-propyl-pyrazole-4-carbothioate Openeye Name: S-(2-pyridyl) 1-(4-chlorophenyl)-5-propyl-pyrazole-4-carbothioate CAS Name: 1-(4-chlorophenyl)-5-propyl-4-pyrazolecarbothioic acid S-(2-pyridinyl) ester IUPAC Name: S-pyridin-2-yl 1-(4-chlorophenyl)-5-propylpyrazole-4-carbothioate Traditional Name: 1-(4-chlorophenyl)-5-propyl-pyrazole-4-carbothioic acid S-(2-pyridyl) ester Formula: C18H16ClN3OS MolecularWeight: 357.85714

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)SC3=CC=CC=N3

Isomeric SMILES

CCCC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)SC3=CC=CC=N3

InChI

InChI=1S/C18H16ClN3OS/c1-2-5-16-15(18(23)24-17-6-3-4-11-20-17)12-21-22(16)14-9-7-13(19)8-10-14/h3-4,6-12H,2,5H2,1H3