N-[(4-bromanyl-3-methyl-phenyl)carbamothioyl]-3-methyl-butanamide

Systemtic Name: N-[(4-bromanyl-3-methyl-phenyl)carbamothioyl]-3-methyl-butanamide Openeye Name: N-[(4-bromo-3-methyl-phenyl)carbamothioyl]-3-methyl-butanamide CAS Name: N-[(4-bromo-3-methylanilino)-sulfanylidenemethyl]-3-methylbutanamide IUPAC Name: N-[(4-bromo-3-methylphenyl)carbamothioyl]-3-methylbutanamide Traditional Name: N-[(4-bromo-3-methyl-phenyl)thiocarbamoyl]-3-methyl-butyramide Formula: C13H17BrN2OS MolecularWeight: 329.25588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=S)NC(=O)CC(C)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=S)NC(=O)CC(C)C)Br

InChI

InChI=1S/C13H17BrN2OS/c1-8(2)6-12(17)16-13(18)15-10-4-5-11(14)9(3)7-10/h4-5,7-8H,6H2,1-3H3,(H2,15,16,17,18)