1-[4-chloranyl-2-ethyl-5-(1,3,5-trimethyl-6-sulfanylidene-pyridin-2-yl)pyrazol-3-yl]ethanone

Systemtic Name: 1-[4-chloranyl-2-ethyl-5-(1,3,5-trimethyl-6-sulfanylidene-pyridin-2-yl)pyrazol-3-yl]ethanone Openeye Name: 1-[4-chloro-2-ethyl-5-(1,3,5-trimethyl-6-thioxo-2-pyridyl)pyrazol-3-yl]ethanone CAS Name: 1-[4-chloro-2-ethyl-5-(1,3,5-trimethyl-6-sulfanylidene-2-pyridinyl)-3-pyrazolyl]ethanone IUPAC Name: 1-[4-chloro-2-ethyl-5-(1,3,5-trimethyl-6-sulfanylidenepyridin-2-yl)pyrazol-3-yl]ethanone Traditional Name: 1-[4-chloro-2-ethyl-5-(1,3,5-trimethyl-6-thioxo-2-pyridyl)pyrazol-3-yl]ethanone Formula: C15H18ClN3OS MolecularWeight: 323.84092

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C2=C(C=C(C(=S)N2C)C)C)Cl)C(=O)C

Isomeric SMILES

CCN1C(=C(C(=N1)C2=C(C=C(C(=S)N2C)C)C)Cl)C(=O)C

InChI

InChI=1S/C15H18ClN3OS/c1-6-19-14(10(4)20)11(16)12(17-19)13-8(2)7-9(3)15(21)18(13)5/h7H,6H2,1-5H3