5-(benzylsulfamoyl)-N-ethyl-2-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide

C24H27N3O4S2 — CID 24981155

IUPAC5-(benzylsulfamoyl)-N-ethyl-2-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide
SMILESCCN(CC(=O)NCc1cccs1)C(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1C
InChIInChI=1S/C24H27N3O4S2/c1-3-27(17-23(28)25-16-20-10-7-13-32-20)24(29)22-14-21(12-11-18(22)2)33(30,31)26-15-19-8-5-4-6-9-19/h4-14,26H,3,15-17H2,1-2H3,(H,25,28)
InChIKeyWXJBVOYNMDNCKT-UHFFFAOYSA-N
MW485.63 g/mol
LogP3.31
Rot. Bonds10

About 5-(benzylsulfamoyl)-N-ethyl-2-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide

5-(benzylsulfamoyl)-N-ethyl-2-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide (PubChem CID 24981155) has the molecular formula C24H27N3O4S2 and a molecular weight of 485.63 g/mol. Its IUPAC name is 5-(benzylsulfamoyl)-N-ethyl-2-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide.

Molecular Properties

Compound Name5-(benzylsulfamoyl)-N-ethyl-2-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide
PubChem CID24981155
Molecular FormulaC24H27N3O4S2
Molecular Weight485.63 g/mol
Exact Mass485.14
IUPAC Name5-(benzylsulfamoyl)-N-ethyl-2-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide
SMILESCCN(CC(=O)NCc1cccs1)C(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1C
InChIInChI=1S/C24H27N3O4S2/c1-3-27(17-23(28)25-16-20-10-7-13-32-20)24(29)22-14-21(12-11-18(22)2)33(30,31)26-15-19-8-5-4-6-9-19/h4-14,26H,3,15-17H2,1-2H3,(H,25,28)
InChIKeyWXJBVOYNMDNCKT-UHFFFAOYSA-N
XLogP3.31
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500485.63
LogP ≤ 53.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-5-(thiophen-2-ylmethylsulfamoyl)benzoic acid
CID 2447471
2-[ethyl-[5-(ethylsulfamoyl)-2-methylbenzoyl]amino]acetic acid
CID 119206509
5-(benzylsulfamoyl)-N-[4-(diethylcarbamoyl)phenyl]-2-methylbenzamide
CID 34543324
2-[[5-(benzylsulfamoyl)-2-methylbenzoyl]-methylamino]propanoic acid
CID 119209339
5-(benzylsulfamoyl)-N-(2-hydroxyethyl)-2-methylbenzamide
CID 71903697
N-ethyl-2-oxo-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]-1H-quinoline-4-carboxamide
CID 4781530
3-(benzylsulfamoyl)-N-(2-thiophen-2-ylethyl)benzamide
CID 27770474
[2-oxo-2-(propylamino)ethyl] 5-(benzylsulfamoyl)-2-methylbenzoate
CID 7837296
N-ethyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]-2,2-diphenylacetamide
CID 4782981
N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-5-(ethylsulfamoyl)-2-methylbenzamide
CID 38370916
5-(benzylsulfamoyl)-N,2-dimethyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 4808865
5-(cyclopropylsulfamoyl)-2-methyl-N,N-bis(thiophen-2-ylmethyl)benzamide
CID 31840744

Frequently Asked Questions

What is the IUPAC name of 5-(benzylsulfamoyl)-N-ethyl-2-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide?
The IUPAC name of 5-(benzylsulfamoyl)-N-ethyl-2-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide (CID 24981155) is 5-(benzylsulfamoyl)-N-ethyl-2-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide.
What is the SMILES notation for 5-(benzylsulfamoyl)-N-ethyl-2-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide?
The canonical SMILES for 5-(benzylsulfamoyl)-N-ethyl-2-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide is CCN(CC(=O)NCc1cccs1)C(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1C.
What is the InChIKey of 5-(benzylsulfamoyl)-N-ethyl-2-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide?
The InChIKey is WXJBVOYNMDNCKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O4S2/c1-3-27(17-23(28)25-16-20-10-7-13-32-20)24(29)22-14-21(12-11-18(22)2)33(30,31)26-15-19-8-5-4-6-9-19/h4-14,26H,3,15-17H2,1-2H3,(H,25,28).
What are the key properties of 5-(benzylsulfamoyl)-N-ethyl-2-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide?
5-(benzylsulfamoyl)-N-ethyl-2-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide has a molecular weight of 485.63 g/mol, XLogP of 3.31, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(benzylsulfamoyl)-N-ethyl-2-methyl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide is sourced from PubChem (CID 24981155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).