N-methyl-2-[(2-methylphenyl)methylsulfanyl]-N-[(1-phenylpyrazol-4-yl)methyl]ethanamide

Systemtic Name: N-methyl-2-[(2-methylphenyl)methylsulfanyl]-N-[(1-phenylpyrazol-4-yl)methyl]ethanamide Openeye Name: N-methyl-2-(o-tolylmethylsulfanyl)-N-[(1-phenylpyrazol-4-yl)methyl]acetamide CAS Name: N-methyl-2-[(2-methylphenyl)methylthio]-N-[(1-phenyl-4-pyrazolyl)methyl]acetamide IUPAC Name: N-methyl-2-[(2-methylphenyl)methylsulfanyl]-N-[(1-phenylpyrazol-4-yl)methyl]acetamide Traditional Name: N-methyl-2-[(2-methylbenzyl)thio]-N-[(1-phenylpyrazol-4-yl)methyl]acetamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCC(=O)N(C)CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1CSCC(=O)N(C)CC2=CN(N=C2)C3=CC=CC=C3

InChI

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