5-chloranyl-3-methyl-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-3-methyl-N-[2-(p-tolylmethylsulfanyl)ethyl]pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-N-[2-[(4-methylphenyl)methylthio]ethyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-3-methyl-N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-3-methyl-N-[2-[(4-methylbenzyl)thio]ethyl]pyrazole-4-carboxamide Formula: C22H24ClN3OS MolecularWeight: 413.96346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCCNC(=O)C2=C(N(N=C2C)CC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CSCCNC(=O)C2=C(N(N=C2C)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C22H24ClN3OS/c1-16-8-10-19(11-9-16)15-28-13-12-24-22(27)20-17(2)25-26(21(20)23)14-18-6-4-3-5-7-18/h3-11H,12-15H2,1-2H3,(H,24,27)