3-methyl-N-(phenylazanylcarbamothioyl)butanamide

Systemtic Name: 3-methyl-N-(phenylazanylcarbamothioyl)butanamide Openeye Name: N-(anilinocarbamothioyl)-3-methyl-butanamide CAS Name: 3-methyl-N-[(phenylhydrazo)-sulfanylidenemethyl]butanamide IUPAC Name: N-(anilinocarbamothioyl)-3-methylbutanamide Traditional Name: N-(anilinothiocarbamoyl)-3-methyl-butyramide Formula: C12H17N3OS MolecularWeight: 251.34788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NNC1=CC=CC=C1

Isomeric SMILES

CC(C)CC(=O)NC(=S)NNC1=CC=CC=C1

InChI

InChI=1S/C12H17N3OS/c1-9(2)8-11(16)13-12(17)15-14-10-6-4-3-5-7-10/h3-7,9,14H,8H2,1-2H3,(H2,13,15,16,17)