ethyl 5-methyl-2-(3-methylsulfanylnaphthalen-2-yl)pyrazole-3-carboxylate

Systemtic Name: ethyl 5-methyl-2-(3-methylsulfanylnaphthalen-2-yl)pyrazole-3-carboxylate Openeye Name: ethyl 5-methyl-2-(3-methylsulfanyl-2-naphthyl)pyrazole-3-carboxylate CAS Name: 5-methyl-2-[3-(methylthio)-2-naphthalenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-(3-methylsulfanylnaphthalen-2-yl)pyrazole-3-carboxylate Traditional Name: 5-methyl-2-[3-(methylthio)-2-naphthyl]pyrazole-3-carboxylic acid ethyl ester Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NN1C2=CC3=CC=CC=C3C=C2SC)C

Isomeric SMILES

CCOC(=O)C1=CC(=NN1C2=CC3=CC=CC=C3C=C2SC)C

InChI

InChI=1S/C18H18N2O2S/c1-4-22-18(21)16-9-12(2)19-20(16)15-10-13-7-5-6-8-14(13)11-17(15)23-3/h5-11H,4H2,1-3H3