N-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]carbamothioyl]-3-methyl-butanamide

Systemtic Name: N-[[3,5-bis(chloranyl)-2-oxidanyl-phenyl]carbamothioyl]-3-methyl-butanamide Openeye Name: N-[(3,5-dichloro-2-hydroxy-phenyl)carbamothioyl]-3-methyl-butanamide CAS Name: N-[(3,5-dichloro-2-hydroxyanilino)-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[(3,5-dichloro-2-hydroxyphenyl)carbamothioyl]-3-methylbutanamide Traditional Name: N-[(3,5-dichloro-2-hydroxy-phenyl)thiocarbamoyl]-3-methyl-butyramide Formula: C12H14Cl2N2O2S MolecularWeight: 321.22276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NC1=CC(=CC(=C1O)Cl)Cl

Isomeric SMILES

CC(C)CC(=O)NC(=S)NC1=CC(=CC(=C1O)Cl)Cl

InChI

InChI=1S/C12H14Cl2N2O2S/c1-6(2)3-10(17)16-12(19)15-9-5-7(13)4-8(14)11(9)18/h4-6,18H,3H2,1-2H3,(H2,15,16,17,19)