5-{[4-(tert-butyl)phenyl]sulfanyl}-1-methyl-3-phenyl-1H-pyrazole-4-carbonitrile structure

5-{[4-(tert-butyl)phenyl]sulfanyl}-1-methyl-3-phenyl-1H-pyrazole-4-carbonitrile

5-(4-tert-butylphenyl)sulfanyl-1-methyl-3-phenylpyrazole-4-carbonitrile

Also Known As: KS-00001QVO|5-{[4-(tert-butyl)phenyl]sulfanyl}-1-methyl-3-phenyl-1H-pyrazole-4-carbonitrile|10L-585S|5-[(4-tert-butylphenyl)sulfanyl]-1-methyl-3-phenyl-1H-pyrazole-4-carbonitrile|5-(4-tert-butylphenyl)sulfanyl-1-methyl-3-phenylpyrazole-4-carbonitrile|5-(4-tert-butylphenyl)sulfanyl-1-methyl-3-phenyl-pyrazole-4-carbonitrile|5-[(4-tert-butylphenyl)sulfanyl]-1-methyl-3-phenylpyrazole-4-carbonitrile|5-[[4-(1,1-Dimethylethyl)phenyl]thio]-1-methyl-3-phenyl-1H-pyrazole-4-carbonitrile|5-{4-(tert-Butyl)phenylsulfanyl}-1-methyl-3-phenyl-1H-pyrazole-4-carbonitrile

CAS: 321998-38-3
Molecular Formula C21H21N3S
Molecular Weight 347.14563 g/mol
LogP 5.40748
Topological Polar Surface Area 41.61 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 3
Exact Mass 347.14563
Monoisotopic Mass 347.14563
Heavy Atoms 25
Complexity 910.7604

Chemical Identifiers

CAS Number 321998-38-3
SMILES CC(C)(C)C1=CC=C(C=C1)SC2=C(C(=NN2C)C3=CC=CC=C3)C#N

Product Overview

5-{[4-(tert-butyl)phenyl]sulfanyl}-1-methyl-3-phenyl-1H-pyrazole-4-carbonitrile (CAS 321998-38-3), with molecular formula C21H21N3S and molecular weight 347.14563 g/mol. IUPAC: 5-(4-tert-butylphenyl)sulfanyl-1-methyl-3-phenylpyrazole-4-carbonitrile.

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