N-(2,5-dimethylphenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]acetamide CAS Name: N-(2,5-dimethylphenyl)-2-[[4-(1-pyrazolyl)phenyl]methylthio]acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]acetamide Traditional Name: N-(2,5-dimethylphenyl)-2-[(4-pyrazol-1-ylbenzyl)thio]acetamide Formula: C20H21N3OS MolecularWeight: 351.46524

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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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3OS/c1-15-4-5-16(2)19(12-15)22-20(24)14-25-13-17-6-8-18(9-7-17)23-11-3-10-21-23/h3-12H,13-14H2,1-2H3,(H,22,24)