5-methyl-1-(2-methylphenyl)-N-[2-(phenylmethylsulfanyl)ethyl]pyrazole-4-carboxamide

Systemtic Name: 5-methyl-1-(2-methylphenyl)-N-[2-(phenylmethylsulfanyl)ethyl]pyrazole-4-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-5-methyl-1-(o-tolyl)pyrazole-4-carboxamide CAS Name: 5-methyl-1-(2-methylphenyl)-N-[2-(phenylmethylthio)ethyl]-4-pyrazolecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-5-methyl-1-(2-methylphenyl)pyrazole-4-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-5-methyl-1-(o-tolyl)pyrazole-4-carboxamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C=N2)C(=O)NCCSCC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C=N2)C(=O)NCCSCC3=CC=CC=C3)C

InChI

InChI=1S/C21H23N3OS/c1-16-8-6-7-11-20(16)24-17(2)19(14-23-24)21(25)22-12-13-26-15-18-9-4-3-5-10-18/h3-11,14H,12-13,15H2,1-2H3,(H,22,25)