4-chloro-3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-methylbenzamide

C16H14Cl2N2O3S — CID 103598151

IUPAC4-chloro-3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-methylbenzamide
SMILESCNC(=O)c1ccc(Cl)c(NS(=O)(=O)C=Cc2ccc(Cl)cc2)c1
InChIInChI=1S/C16H14Cl2N2O3S/c1-19-16(21)12-4-7-14(18)15(10-12)20-24(22,23)9-8-11-2-5-13(17)6-3-11/h2-10,20H,1H3,(H,19,21)
InChIKeyYBUAIBYNPQERIK-UHFFFAOYSA-N
MW385.27 g/mol
LogP3.77
Rot. Bonds5

About 4-chloro-3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-methylbenzamide

4-chloro-3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-methylbenzamide (PubChem CID 103598151) has the molecular formula C16H14Cl2N2O3S and a molecular weight of 385.27 g/mol. Its IUPAC name is 4-chloro-3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-methylbenzamide.

Molecular Properties

Compound Name4-chloro-3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-methylbenzamide
PubChem CID103598151
Molecular FormulaC16H14Cl2N2O3S
Molecular Weight385.27 g/mol
Exact Mass384.01
IUPAC Name4-chloro-3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-methylbenzamide
SMILESCNC(=O)c1ccc(Cl)c(NS(=O)(=O)C=Cc2ccc(Cl)cc2)c1
InChIInChI=1S/C16H14Cl2N2O3S/c1-19-16(21)12-4-7-14(18)15(10-12)20-24(22,23)9-8-11-2-5-13(17)6-3-11/h2-10,20H,1H3,(H,19,21)
InChIKeyYBUAIBYNPQERIK-UHFFFAOYSA-N
XLogP3.77
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.27
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[(E)-2-(4-chlorophenyl)ethenyl]sulfonylamino]benzamide
CID 6213409
2-[[(E)-2-(4-chlorophenyl)ethenyl]sulfonylamino]-N-methylacetamide
CID 9302302
3-[[(E)-2-(4-chlorophenyl)ethenyl]sulfonylamino]-4-methylbenzenesulfonamide
CID 90481162
4-chloro-N-methyl-3-(1H-pyrazol-5-ylsulfonylamino)benzamide
CID 102692631
4-chloro-3-[(5-fluoro-2-methylphenyl)sulfonylamino]-N-methylbenzamide
CID 87027257
(E)-2-(4-chlorophenyl)-N-[4-(methanesulfonamido)phenyl]ethenesulfonamide
CID 31073687
N'-[(E)-2-(4-chlorophenyl)ethenyl]sulfonylacetohydrazide
CID 8500743
4-chloro-3-[(2,6-dichlorophenyl)methylamino]-N-methylbenzamide
CID 43720994
2-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-cyclopropylbenzamide
CID 71835079
4-[2-(4-chlorophenyl)ethenylsulfonylamino]-3-fluorobenzenesulfonamide
CID 76869846
4-[[[(E)-2-(4-chlorophenyl)ethenyl]sulfonyl-cyclopropylamino]methyl]-N-methylbenzamide
CID 24679248
4-chloro-3-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-methylbenzamide
CID 87027249

Frequently Asked Questions

What is the IUPAC name of 4-chloro-3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-methylbenzamide?
The IUPAC name of 4-chloro-3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-methylbenzamide (CID 103598151) is 4-chloro-3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-methylbenzamide.
What is the SMILES notation for 4-chloro-3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-methylbenzamide?
The canonical SMILES for 4-chloro-3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-methylbenzamide is CNC(=O)c1ccc(Cl)c(NS(=O)(=O)C=Cc2ccc(Cl)cc2)c1.
What is the InChIKey of 4-chloro-3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-methylbenzamide?
The InChIKey is YBUAIBYNPQERIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2N2O3S/c1-19-16(21)12-4-7-14(18)15(10-12)20-24(22,23)9-8-11-2-5-13(17)6-3-11/h2-10,20H,1H3,(H,19,21).
What are the key properties of 4-chloro-3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-methylbenzamide?
4-chloro-3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-methylbenzamide has a molecular weight of 385.27 g/mol, XLogP of 3.77, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-3-[2-(4-chlorophenyl)ethenylsulfonylamino]-N-methylbenzamide is sourced from PubChem (CID 103598151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).