2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[[4-(1-pyrazolyl)phenyl]methylthio]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: N-mesityl-2-[(4-pyrazol-1-ylbenzyl)thio]acetamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CSCC2=CC=C(C=C2)N3C=CC=N3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CSCC2=CC=C(C=C2)N3C=CC=N3)C

InChI

InChI=1S/C21H23N3OS/c1-15-11-16(2)21(17(3)12-15)23-20(25)14-26-13-18-5-7-19(8-6-18)24-10-4-9-22-24/h4-12H,13-14H2,1-3H3,(H,23,25)