5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]-N-(3-phenylsulfanylpropyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]-N-(3-phenylsulfanylpropyl)pyrazole-4-carboxamide Openeye Name: 5-chloro-3-methyl-N-(3-phenylsulfanylpropyl)-1-(p-tolylmethyl)pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-N-[3-(phenylthio)propyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-N-(3-phenylsulfanylpropyl)pyrazole-4-carboxamide Traditional Name: 5-chloro-3-methyl-1-(4-methylbenzyl)-N-[3-(phenylthio)propyl]pyrazole-4-carboxamide Formula: C22H24ClN3OS MolecularWeight: 413.96346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NCCCSC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NCCCSC3=CC=CC=C3)Cl

InChI

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