5-chloranyl-1-[(2-chlorophenyl)methyl]-3-methyl-N-[2-(4-methylphenyl)sulfanylethyl]pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-1-[(2-chlorophenyl)methyl]-3-methyl-N-[2-(4-methylphenyl)sulfanylethyl]pyrazole-4-carboxamide Openeye Name: 5-chloro-1-[(2-chlorophenyl)methyl]-3-methyl-N-[2-(p-tolylsulfanyl)ethyl]pyrazole-4-carboxamide CAS Name: 5-chloro-1-[(2-chlorophenyl)methyl]-3-methyl-N-[2-[(4-methylphenyl)thio]ethyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-1-[(2-chlorophenyl)methyl]-3-methyl-N-[2-(4-methylphenyl)sulfanylethyl]pyrazole-4-carboxamide Traditional Name: 5-chloro-1-(2-chlorobenzyl)-3-methyl-N-[2-(p-tolylthio)ethyl]pyrazole-4-carboxamide Formula: C21H21Cl2N3OS MolecularWeight: 434.38194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2=C(N(N=C2C)CC3=CC=CC=C3Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2=C(N(N=C2C)CC3=CC=CC=C3Cl)Cl

InChI

InChI=1S/C21H21Cl2N3OS/c1-14-7-9-17(10-8-14)28-12-11-24-21(27)19-15(2)25-26(20(19)23)13-16-5-3-4-6-18(16)22/h3-10H,11-13H2,1-2H3,(H,24,27)