(3E)-N-(2-acetamidophenyl)-3-(carbamothioylhydrazinylidene)butanamide

Systemtic Name: (3E)-N-(2-acetamidophenyl)-3-(carbamothioylhydrazinylidene)butanamide Openeye Name: (3E)-N-(2-acetamidophenyl)-3-(carbamothioylhydrazono)butanamide CAS Name: (3E)-N-(2-acetamidophenyl)-3-(carbamothioylhydrazinylidene)butanamide IUPAC Name: (3E)-N-(2-acetamidophenyl)-3-(carbamothioylhydrazinylidene)butanamide Traditional Name: (3E)-N-(2-acetamidophenyl)-3-(thiocarbamoylhydrazono)butyramide Formula: C13H17N5O2S MolecularWeight: 307.37138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)N)CC(=O)NC1=CC=CC=C1NC(=O)C

Isomeric SMILES

C/C(=N\NC(=S)N)/CC(=O)NC1=CC=CC=C1NC(=O)C

InChI

InChI=1S/C13H17N5O2S/c1-8(17-18-13(14)21)7-12(20)16-11-6-4-3-5-10(11)15-9(2)19/h3-6H,7H2,1-2H3,(H,15,19)(H,16,20)(H3,14,18,21)/b17-8+