N-[thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide

C15H13NO2S3 — CID 121021426

IUPACN-[thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide
SMILESO=S(=O)(NC(c1ccsc1)c1cccs1)c1ccccc1
InChIInChI=1S/C15H13NO2S3/c17-21(18,13-5-2-1-3-6-13)16-15(12-8-10-19-11-12)14-7-4-9-20-14/h1-11,15-16H
InChIKeyZGNIVQKBXFUORU-UHFFFAOYSA-N
MW335.48 g/mol
LogP3.88
Rot. Bonds5

About N-[thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide

N-[thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide (PubChem CID 121021426) has the molecular formula C15H13NO2S3 and a molecular weight of 335.48 g/mol. Its IUPAC name is N-[thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide
PubChem CID121021426
Molecular FormulaC15H13NO2S3
Molecular Weight335.48 g/mol
Exact Mass335.01
IUPAC NameN-[thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide
SMILESO=S(=O)(NC(c1ccsc1)c1cccs1)c1ccccc1
InChIInChI=1S/C15H13NO2S3/c17-21(18,13-5-2-1-3-6-13)16-15(12-8-10-19-11-12)14-7-4-9-20-14/h1-11,15-16H
InChIKeyZGNIVQKBXFUORU-UHFFFAOYSA-N
XLogP3.88
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.48
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(S)-thiophen-2-yl(thiophen-3-yl)methyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 129355139
4-(2-methyl-1,3-oxazol-4-yl)-N-[(S)-thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide
CID 129357101
N-[(S)-phenyl(thiophen-2-yl)methyl]thiophene-2-sulfonamide
CID 8815899
N-[(R)-phenyl(thiophen-2-yl)methyl]thiophene-2-sulfonamide
CID 8815903
N-[(1S)-2-methyl-1-thiophen-2-ylpropyl]benzenesulfonamide
CID 38256287
N-(dithiophen-2-ylmethyl)-4-methylbenzenesulfonamide
CID 12000205
N-[(1S)-2,2,2-trichloro-1-thiophen-2-ylethyl]benzenesulfonamide
CID 1116511
2,6-dichloro-N-[phenyl(thiophen-2-yl)methyl]benzenesulfonamide
CID 24678420
ethyl 4-[[(S)-phenyl(thiophen-2-yl)methyl]sulfamoyl]benzoate
CID 8816031
3-chloro-N-[(4-methylphenyl)-thiophen-2-ylmethyl]benzenesulfonamide
CID 18279348
N-[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]-4-nitrobenzenesulfonamide
CID 8816308
N-[(S)-diphenoxyphosphoryl(thiophen-2-yl)methyl]benzenesulfonamide
CID 2307159

Frequently Asked Questions

What is the IUPAC name of N-[thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide?
The IUPAC name of N-[thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide (CID 121021426) is N-[thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide.
What is the SMILES notation for N-[thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide?
The canonical SMILES for N-[thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide is O=S(=O)(NC(c1ccsc1)c1cccs1)c1ccccc1.
What is the InChIKey of N-[thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide?
The InChIKey is ZGNIVQKBXFUORU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO2S3/c17-21(18,13-5-2-1-3-6-13)16-15(12-8-10-19-11-12)14-7-4-9-20-14/h1-11,15-16H.
What are the key properties of N-[thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide?
N-[thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide has a molecular weight of 335.48 g/mol, XLogP of 3.88, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[thiophen-2-yl(thiophen-3-yl)methyl]benzenesulfonamide is sourced from PubChem (CID 121021426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).