2-[2-(4-chloroanilino)-2-oxoethyl]sulfanyl-N-cyclopentylacetamide

HCID 7749232

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Basic information

CAS: 881291-08-3
Standard SMILES: O=C(CSCC(=O)NC1CCCC1)Nc1ccc(Cl)cc1
InChIKey: BNSVYXSAMBXMRN-UHFFFAOYSA-N
Molecular formula: C15H19ClN2O2S
Average molar mass: 326.8 g/mol
Monoisotopic mass: 326.0855767

Names & identifiers

Preferred name: 2-[2-(4-chloroanilino)-2-oxoethyl]sulfanyl-N-cyclopentylacetamide
IUPAC: 2-[2-(4-chloroanilino)-2-oxoethyl]sulfanyl-N-cyclopentylacetamide

Names & synonyms

881291-08-32-[[2-[(4-Chlorophenyl)amino]-2-oxoethyl]thio]-N-cyclopentylacetamide2-({2-[(4-chlorophenyl)amino]-2-oxoethyl}thio)-N-cyclopentylacetamideDTXSID8011572562-[2-(4-chloroanilino)-2-oxoethyl]sulfanyl-N-cyclopentylacetamideAKOS0030517382-{[2-(4-Chloroanilino)-2-oxoethyl]sulfanyl}-N-cyclopentylacetamide

Database identifiers

CAS: 881291-08-3
PubChem CID: 7749232
DTXSID: DTXSID801157256

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 83.5 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 3
Rotatable bonds: 6
Heavy atoms: 21
Formal charge: 0
Complexity: 354

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