3-(dimethylsulfamoyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide

C20H18N4O3S2 — CID 33008158

IUPAC3-(dimethylsulfamoyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)Nc2c(-c3ccccc3)nc3sccn23)c1
InChIInChI=1S/C20H18N4O3S2/c1-23(2)29(26,27)16-10-6-9-15(13-16)19(25)22-18-17(14-7-4-3-5-8-14)21-20-24(18)11-12-28-20/h3-13H,1-2H3,(H,22,25)
InChIKeyMUWIOILLWYOCEU-UHFFFAOYSA-N
MW426.52 g/mol
LogP3.57
Rot. Bonds5

About 3-(dimethylsulfamoyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide

3-(dimethylsulfamoyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide (PubChem CID 33008158) has the molecular formula C20H18N4O3S2 and a molecular weight of 426.52 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide
PubChem CID33008158
Molecular FormulaC20H18N4O3S2
Molecular Weight426.52 g/mol
Exact Mass426.08
IUPAC Name3-(dimethylsulfamoyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide
SMILESCN(C)S(=O)(=O)c1cccc(C(=O)Nc2c(-c3ccccc3)nc3sccn23)c1
InChIInChI=1S/C20H18N4O3S2/c1-23(2)29(26,27)16-10-6-9-15(13-16)19(25)22-18-17(14-7-4-3-5-8-14)21-20-24(18)11-12-28-20/h3-13H,1-2H3,(H,22,25)
InChIKeyMUWIOILLWYOCEU-UHFFFAOYSA-N
XLogP3.57
TPSA83.78 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.52
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide?
The IUPAC name of 3-(dimethylsulfamoyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide (CID 33008158) is 3-(dimethylsulfamoyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide.
What is the SMILES notation for 3-(dimethylsulfamoyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide?
The canonical SMILES for 3-(dimethylsulfamoyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide is CN(C)S(=O)(=O)c1cccc(C(=O)Nc2c(-c3ccccc3)nc3sccn23)c1.
What is the InChIKey of 3-(dimethylsulfamoyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide?
The InChIKey is MUWIOILLWYOCEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4O3S2/c1-23(2)29(26,27)16-10-6-9-15(13-16)19(25)22-18-17(14-7-4-3-5-8-14)21-20-24(18)11-12-28-20/h3-13H,1-2H3,(H,22,25).
What are the key properties of 3-(dimethylsulfamoyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide?
3-(dimethylsulfamoyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide has a molecular weight of 426.52 g/mol, XLogP of 3.57, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoyl)-N-(6-phenylimidazo[2,1-b][1,3]thiazol-5-yl)benzamide is sourced from PubChem (CID 33008158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).