3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide

C15H10F3N3O3S3 — CID 78897587

IUPAC3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide
SMILESO=C(Nc1nc(C(F)(F)F)cs1)c1cccc(NS(=O)(=O)c2cccs2)c1
InChIInChI=1S/C15H10F3N3O3S3/c16-15(17,18)11-8-26-14(19-11)20-13(22)9-3-1-4-10(7-9)21-27(23,24)12-5-2-6-25-12/h1-8,21H,(H,19,20,22)
InChIKeyXNZQOLGBYAGHTK-UHFFFAOYSA-N
MW433.46 g/mol
LogP4.28
Rot. Bonds5

About 3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide

3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide (PubChem CID 78897587) has the molecular formula C15H10F3N3O3S3 and a molecular weight of 433.46 g/mol. Its IUPAC name is 3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide.

Molecular Properties

Compound Name3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide
PubChem CID78897587
Molecular FormulaC15H10F3N3O3S3
Molecular Weight433.46 g/mol
Exact Mass432.98
IUPAC Name3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide
SMILESO=C(Nc1nc(C(F)(F)F)cs1)c1cccc(NS(=O)(=O)c2cccs2)c1
InChIInChI=1S/C15H10F3N3O3S3/c16-15(17,18)11-8-26-14(19-11)20-13(22)9-3-1-4-10(7-9)21-27(23,24)12-5-2-6-25-12/h1-8,21H,(H,19,20,22)
InChIKeyXNZQOLGBYAGHTK-UHFFFAOYSA-N
XLogP4.28
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.46
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(5-phenyl-1,3,4-thiadiazol-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide
CID 55793963
N-(2,3-dimethylphenyl)-3-(thiophen-2-ylsulfonylamino)benzamide
CID 55786528
N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-3-(thiophen-2-ylsulfonylamino)benzamide
CID 46492108
3-(benzenesulfonamido)-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 24686775
N-(2-fluoro-4-methylphenyl)-3-(thiophen-2-ylsulfonylamino)benzamide
CID 55914376
4-(thiophen-2-ylsulfonylamino)-N-(4-thiophen-2-yl-1,3-thiazol-2-yl)benzamide
CID 55376558
N-[4-[3-(thiophen-2-ylsulfonylamino)phenyl]-1,3-thiazol-2-yl]acetamide
CID 155557473
N-[3-(1,3-thiazol-2-yl)phenyl]-3-(thiophen-2-ylsulfonylamino)benzamide
CID 55991234
N-(4-phenyl-1,3-thiazol-2-yl)-3-[[3-(trifluoromethyl)phenyl]sulfamoyl]benzamide
CID 2344834
N-(1-hydroxypropan-2-yl)-3-(thiophen-2-ylsulfonylamino)benzamide
CID 78896710
N-[5-(cyanomethylsulfanyl)-4-methyl-1,3-thiazol-2-yl]-3-(thiophen-2-ylsulfonylamino)benzamide
CID 55846875
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(thiophen-2-ylsulfonylamino)benzamide
CID 46487765

Frequently Asked Questions

What is the IUPAC name of 3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide?
The IUPAC name of 3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide (CID 78897587) is 3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide.
What is the SMILES notation for 3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide?
The canonical SMILES for 3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide is O=C(Nc1nc(C(F)(F)F)cs1)c1cccc(NS(=O)(=O)c2cccs2)c1.
What is the InChIKey of 3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide?
The InChIKey is XNZQOLGBYAGHTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F3N3O3S3/c16-15(17,18)11-8-26-14(19-11)20-13(22)9-3-1-4-10(7-9)21-27(23,24)12-5-2-6-25-12/h1-8,21H,(H,19,20,22).
What are the key properties of 3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide?
3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide has a molecular weight of 433.46 g/mol, XLogP of 4.28, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(thiophen-2-ylsulfonylamino)-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide is sourced from PubChem (CID 78897587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).