N-(2-propan-2-ylphenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]ethanamide

Systemtic Name: N-(2-propan-2-ylphenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]ethanamide Openeye Name: N-(2-isopropylphenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]acetamide CAS Name: N-(2-propan-2-ylphenyl)-2-[[4-(1-pyrazolyl)phenyl]methylthio]acetamide IUPAC Name: N-(2-propan-2-ylphenyl)-2-[(4-pyrazol-1-ylphenyl)methylsulfanyl]acetamide Traditional Name: N-o-cumenyl-2-[(4-pyrazol-1-ylbenzyl)thio]acetamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)CSCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)CSCC2=CC=C(C=C2)N3C=CC=N3

InChI

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