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

Systemtic Name: N-(2,6-diethylphenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]ethanamide Openeye Name: N-(2,6-diethylphenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]acetamide CAS Name: N-(2,6-diethylphenyl)-2-[[4-(1-pyrazolyl)phenyl]methylthio]acetamide IUPAC Name: N-(2,6-diethylphenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]acetamide Traditional Name: N-(2,6-diethylphenyl)-2-[(4-pyrazol-1-ylbenzyl)thio]acetamide Formula: C22H25N3OS MolecularWeight: 379.5184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CSCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CSCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C22H25N3OS/c1-3-18-7-5-8-19(4-2)22(18)24-21(26)16-27-15-17-9-11-20(12-10-17)25-14-6-13-23-25/h5-14H,3-4,15-16H2,1-2H3,(H,24,26)