6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide

C21H19ClN4O4S2 — CID 16605008

IUPAC6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
SMILESCCN(c1ccccc1)S(=O)(=O)c1ccc(OC)c(NC(=O)c2c(Cl)nc3sccn23)c1
InChIInChI=1S/C21H19ClN4O4S2/c1-3-26(14-7-5-4-6-8-14)32(28,29)15-9-10-17(30-2)16(13-15)23-20(27)18-19(22)24-21-25(18)11-12-31-21/h4-13H,3H2,1-2H3,(H,23,27)
InChIKeyUEOAGAJNOQVUIB-UHFFFAOYSA-N
MW490.99 g/mol
LogP4.53
Rot. Bonds7

About 6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide

6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide (PubChem CID 16605008) has the molecular formula C21H19ClN4O4S2 and a molecular weight of 490.99 g/mol. Its IUPAC name is 6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
PubChem CID16605008
Molecular FormulaC21H19ClN4O4S2
Molecular Weight490.99 g/mol
Exact Mass490.05
IUPAC Name6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
SMILESCCN(c1ccccc1)S(=O)(=O)c1ccc(OC)c(NC(=O)c2c(Cl)nc3sccn23)c1
InChIInChI=1S/C21H19ClN4O4S2/c1-3-26(14-7-5-4-6-8-14)32(28,29)15-9-10-17(30-2)16(13-15)23-20(27)18-19(22)24-21-25(18)11-12-31-21/h4-13H,3H2,1-2H3,(H,23,27)
InChIKeyUEOAGAJNOQVUIB-UHFFFAOYSA-N
XLogP4.53
TPSA93.01 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500490.99
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]-6-methylpyridine-2-carboxamide
CID 31912749
6-chloro-N-[2-chloro-5-[(2-methoxyphenyl)sulfamoyl]phenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide
CID 4069364
4,5-dichloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]-1-methylpyrrole-2-carboxamide
CID 55600473
N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]naphthalene-1-carboxamide
CID 4801217
1-benzyl-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]-6-oxopyridazine-3-carboxamide
CID 16547973
N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]-2-oxo-6-thia-1,8-diazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carboxamide
CID 5033170
N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]-2-piperidin-1-ylacetamide
CID 4826047
cis-(1S,2R)-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]-2-methylcyclopropane-1-carboxamide
CID 129421663
N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]-2-pyridin-2-ylquinoline-4-carboxamide
CID 4216551
4-[ethyl(phenyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide
CID 2084993
2-(1,3-benzoxazol-2-ylsulfanyl)-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]acetamide
CID 5167164
3-[ethyl(phenyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide
CID 26914975

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide?
The IUPAC name of 6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide (CID 16605008) is 6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide.
What is the SMILES notation for 6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide?
The canonical SMILES for 6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide is CCN(c1ccccc1)S(=O)(=O)c1ccc(OC)c(NC(=O)c2c(Cl)nc3sccn23)c1.
What is the InChIKey of 6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide?
The InChIKey is UEOAGAJNOQVUIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19ClN4O4S2/c1-3-26(14-7-5-4-6-8-14)32(28,29)15-9-10-17(30-2)16(13-15)23-20(27)18-19(22)24-21-25(18)11-12-31-21/h4-13H,3H2,1-2H3,(H,23,27).
What are the key properties of 6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide?
6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide has a molecular weight of 490.99 g/mol, XLogP of 4.53, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[5-[ethyl(phenyl)sulfamoyl]-2-methoxyphenyl]imidazo[2,1-b][1,3]thiazole-5-carboxamide is sourced from PubChem (CID 16605008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).