1-[(2-chlorophenyl)methyl]-3,5-dimethyl-N-(4-methylsulfanylphenyl)pyrazole-4-carboxamide

Systemtic Name: 1-[(2-chlorophenyl)methyl]-3,5-dimethyl-N-(4-methylsulfanylphenyl)pyrazole-4-carboxamide Openeye Name: 1-[(2-chlorophenyl)methyl]-3,5-dimethyl-N-(4-methylsulfanylphenyl)pyrazole-4-carboxamide CAS Name: 1-[(2-chlorophenyl)methyl]-3,5-dimethyl-N-[4-(methylthio)phenyl]-4-pyrazolecarboxamide IUPAC Name: 1-[(2-chlorophenyl)methyl]-3,5-dimethyl-N-(4-methylsulfanylphenyl)pyrazole-4-carboxamide Traditional Name: 1-(2-chlorobenzyl)-3,5-dimethyl-N-[4-(methylthio)phenyl]pyrazole-4-carboxamide Formula: C20H20ClN3OS MolecularWeight: 385.9103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)C(=O)NC3=CC=C(C=C3)SC

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2Cl)C)C(=O)NC3=CC=C(C=C3)SC

InChI

InChI=1S/C20H20ClN3OS/c1-13-19(20(25)22-16-8-10-17(26-3)11-9-16)14(2)24(23-13)12-15-6-4-5-7-18(15)21/h4-11H,12H2,1-3H3,(H,22,25)