N-(4-oxo-1,3-thiazolidin-2-ylidene)benzamide

C10H8N2O2S — CID 135444990

IUPACN-(4-oxo-1,3-thiazolidin-2-ylidene)benzamide
SMILESO=C1CS/C(=N/C(=O)c2ccccc2)N1
InChIInChI=1S/C10H8N2O2S/c13-8-6-15-10(11-8)12-9(14)7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12,13,14)
InChIKeyRGNSLKVDXRETCU-UHFFFAOYSA-N
MW220.25 g/mol
LogP1.05
Rot. Bonds1

About N-(4-oxo-1,3-thiazolidin-2-ylidene)benzamide

N-(4-oxo-1,3-thiazolidin-2-ylidene)benzamide (PubChem CID 135444990) has the molecular formula C10H8N2O2S and a molecular weight of 220.25 g/mol. Its IUPAC name is N-(4-oxo-1,3-thiazolidin-2-ylidene)benzamide.

Molecular Properties

Compound NameN-(4-oxo-1,3-thiazolidin-2-ylidene)benzamide
PubChem CID135444990
Molecular FormulaC10H8N2O2S
Molecular Weight220.25 g/mol
Exact Mass220.03
IUPAC NameN-(4-oxo-1,3-thiazolidin-2-ylidene)benzamide
SMILESO=C1CS/C(=N/C(=O)c2ccccc2)N1
InChIInChI=1S/C10H8N2O2S/c13-8-6-15-10(11-8)12-9(14)7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12,13,14)
InChIKeyRGNSLKVDXRETCU-UHFFFAOYSA-N
XLogP1.05
TPSA58.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.25
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-(4,5-Dihydro-1,3-thiazol-2-yl)-4-methylbenzamide
CID 776902
N-(4,5-Dihydro-thiazol-2-yl)-benzamide
CID 802148
N-(4,5-Dihydro-2-thiazolyl)-3-methylbenzamide
CID 799139
4-cyano-N-(4,5-dihydro-1,3-thiazol-2-yl)benzamide
CID 2423237
3M-519S
CID 4553009
N-(4,5-dihydro-1,3-thiazol-2-yl)-3-fluorobenzamide
CID 821560
N-(4,5-dihydro-1,3-thiazol-2-yl)-4-(trifluoromethyl)benzamide
CID 2402452
N-[2-(4,5-dihydro-1,3-thiazol-2-ylamino)-2-oxoethyl]-2-fluorobenzamide
CID 745463
methyl (2Z)-[2-{[(4-methylphenyl)carbonyl]amino}-4-oxo-1,3-thiazol-5(4H)-ylidene]ethanoate
CID 135408458
(E)-methyl 2-(2-(4-fluorobenzamido)-4-oxothiazol-5(4H)-ylidene)acetate
CID 135461890
Benzoic acid [4-oxo-thiazolidin-(2E)-ylidene]-hydrazide
CID 135759036
N-(3-hydroxy-1,2,4-thiadiazol-5-yl)-4-methylbenzenecarboxamide
CID 1475545

Frequently Asked Questions

What is the IUPAC name of N-(4-oxo-1,3-thiazolidin-2-ylidene)benzamide?
The IUPAC name of N-(4-oxo-1,3-thiazolidin-2-ylidene)benzamide (CID 135444990) is N-(4-oxo-1,3-thiazolidin-2-ylidene)benzamide.
What is the SMILES notation for N-(4-oxo-1,3-thiazolidin-2-ylidene)benzamide?
The canonical SMILES for N-(4-oxo-1,3-thiazolidin-2-ylidene)benzamide is O=C1CS/C(=N/C(=O)c2ccccc2)N1.
What is the InChIKey of N-(4-oxo-1,3-thiazolidin-2-ylidene)benzamide?
The InChIKey is RGNSLKVDXRETCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N2O2S/c13-8-6-15-10(11-8)12-9(14)7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12,13,14).
What are the key properties of N-(4-oxo-1,3-thiazolidin-2-ylidene)benzamide?
N-(4-oxo-1,3-thiazolidin-2-ylidene)benzamide has a molecular weight of 220.25 g/mol, XLogP of 1.05, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-oxo-1,3-thiazolidin-2-ylidene)benzamide is sourced from PubChem (CID 135444990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).