N-[(4-bromanyl-2,6-dimethyl-phenyl)carbamothioyl]-4-chloranyl-butanamide

Systemtic Name: N-[(4-bromanyl-2,6-dimethyl-phenyl)carbamothioyl]-4-chloranyl-butanamide Openeye Name: N-[(4-bromo-2,6-dimethyl-phenyl)carbamothioyl]-4-chloro-butanamide CAS Name: N-[(4-bromo-2,6-dimethylanilino)-sulfanylidenemethyl]-4-chlorobutanamide IUPAC Name: N-[(4-bromo-2,6-dimethylphenyl)carbamothioyl]-4-chlorobutanamide Traditional Name: N-[(4-bromo-2,6-dimethyl-phenyl)thiocarbamoyl]-4-chloro-butyramide Formula: C13H16BrClN2OS MolecularWeight: 363.70094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=S)NC(=O)CCCCl)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC(=S)NC(=O)CCCCl)C)Br

InChI

InChI=1S/C13H16BrClN2OS/c1-8-6-10(14)7-9(2)12(8)17-13(19)16-11(18)4-3-5-15/h6-7H,3-5H2,1-2H3,(H2,16,17,18,19)