N-(4-chlorophenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide

C24H20ClN3OS — CID 4121670

IUPACN-(4-chlorophenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide
SMILESCc1ccccc1-n1cc(-c2ccccc2)nc1SCC(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C24H20ClN3OS/c1-17-7-5-6-10-22(17)28-15-21(18-8-3-2-4-9-18)27-24(28)30-16-23(29)26-20-13-11-19(25)12-14-20/h2-15H,16H2,1H3,(H,26,29)
InChIKeyZQWQMAVIUUUUMG-UHFFFAOYSA-N
MW433.96 g/mol
LogP6.23
Rot. Bonds6

About N-(4-chlorophenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide

N-(4-chlorophenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide (PubChem CID 4121670) has the molecular formula C24H20ClN3OS and a molecular weight of 433.96 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide
PubChem CID4121670
Molecular FormulaC24H20ClN3OS
Molecular Weight433.96 g/mol
Exact Mass433.10
IUPAC NameN-(4-chlorophenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide
SMILESCc1ccccc1-n1cc(-c2ccccc2)nc1SCC(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C24H20ClN3OS/c1-17-7-5-6-10-22(17)28-15-21(18-8-3-2-4-9-18)27-24(28)30-16-23(29)26-20-13-11-19(25)12-14-20/h2-15H,16H2,1H3,(H,26,29)
InChIKeyZQWQMAVIUUUUMG-UHFFFAOYSA-N
XLogP6.23
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500433.96
LogP ≤ 56.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanyl-N-phenylacetamide
CID 4121667
N-(4-methylphenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide
CID 4126512
2-[4-(4-chlorophenyl)-1-(2-fluorophenyl)imidazol-2-yl]sulfanyl-N-(4-methoxyphenyl)acetamide
CID 4618494
2-(1,4-diphenylimidazol-2-yl)sulfanyl-N-(4-methylphenyl)acetamide
CID 4088320
N-(5-chloro-2-methylphenyl)-2-(1,4-diphenylimidazol-2-yl)sulfanylacetamide
CID 23961762
2-[1-(5-chloro-2-methoxyphenyl)-4-phenylimidazol-2-yl]sulfanyl-N-(2,3-dimethylphenyl)acetamide
CID 4673985
2-[1,4-bis(4-methoxyphenyl)imidazol-2-yl]sulfanyl-N-phenylacetamide
CID 4558088
N-(4-chloro-2-hydroxyphenyl)-2-(1,4-diphenylimidazol-2-yl)sulfanylacetamide
CID 23909049
1-(4-chlorophenyl)-2-[4-(4-chlorophenyl)-1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylethanone
CID 3292571
N-(2,3-dimethylphenyl)-2-[1-(4-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide
CID 3458291
N-(4-chlorophenyl)-2-[1-(2-methylbenzoyl)-5-phenylimidazol-2-yl]sulfanylacetamide
CID 1374976
N-(4-chlorophenyl)-2-[[5-(2-methylphenyl)-4-oxo-1H-pyrazolo[5,4-d]pyrimidin-6-yl]sulfanyl]acetamide
CID 4073559

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide?
The IUPAC name of N-(4-chlorophenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide (CID 4121670) is N-(4-chlorophenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide is Cc1ccccc1-n1cc(-c2ccccc2)nc1SCC(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide?
The InChIKey is ZQWQMAVIUUUUMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20ClN3OS/c1-17-7-5-6-10-22(17)28-15-21(18-8-3-2-4-9-18)27-24(28)30-16-23(29)26-20-13-11-19(25)12-14-20/h2-15H,16H2,1H3,(H,26,29).
What are the key properties of N-(4-chlorophenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide?
N-(4-chlorophenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide has a molecular weight of 433.96 g/mol, XLogP of 6.23, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-[1-(2-methylphenyl)-4-phenylimidazol-2-yl]sulfanylacetamide is sourced from PubChem (CID 4121670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).