N-[[3,5-bis(chloranyl)-4-oxidanyl-phenyl]carbamothioyl]pentanamide

Systemtic Name: N-[[3,5-bis(chloranyl)-4-oxidanyl-phenyl]carbamothioyl]pentanamide Openeye Name: N-[(3,5-dichloro-4-hydroxy-phenyl)carbamothioyl]pentanamide CAS Name: N-[(3,5-dichloro-4-hydroxyanilino)-sulfanylidenemethyl]pentanamide IUPAC Name: N-[(3,5-dichloro-4-hydroxyphenyl)carbamothioyl]pentanamide Traditional Name: N-[(3,5-dichloro-4-hydroxy-phenyl)thiocarbamoyl]valeramide Formula: C12H14Cl2N2O2S MolecularWeight: 321.22276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC(=C(C(=C1)Cl)O)Cl

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC(=C(C(=C1)Cl)O)Cl

InChI

InChI=1S/C12H14Cl2N2O2S/c1-2-3-4-10(17)16-12(19)15-7-5-8(13)11(18)9(14)6-7/h5-6,18H,2-4H2,1H3,(H2,15,16,17,19)