5-chloranyl-3-methyl-1-(2-methylpropyl)-N-(3-methylsulfanylphenyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-1-(2-methylpropyl)-N-(3-methylsulfanylphenyl)pyrazole-4-carboxamide Openeye Name: 5-chloro-1-isobutyl-3-methyl-N-(3-methylsulfanylphenyl)pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-1-(2-methylpropyl)-N-[3-(methylthio)phenyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-3-methyl-1-(2-methylpropyl)-N-(3-methylsulfanylphenyl)pyrazole-4-carboxamide Traditional Name: 5-chloro-1-isobutyl-3-methyl-N-[3-(methylthio)phenyl]pyrazole-4-carboxamide Formula: C16H20ClN3OS MolecularWeight: 337.8675

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NC2=CC(=CC=C2)SC)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)NC2=CC(=CC=C2)SC)Cl)CC(C)C

InChI

InChI=1S/C16H20ClN3OS/c1-10(2)9-20-15(17)14(11(3)19-20)16(21)18-12-6-5-7-13(8-12)22-4/h5-8,10H,9H2,1-4H3,(H,18,21)