3-methyl-N-[(3-phenylpropanoylamino)carbamothioyl]butanamide

Systemtic Name: 3-methyl-N-[(3-phenylpropanoylamino)carbamothioyl]butanamide Openeye Name: 3-methyl-N-[(3-phenylpropanoylamino)carbamothioyl]butanamide CAS Name: 3-methyl-N-[[(1-oxo-3-phenylpropyl)hydrazo]-sulfanylidenemethyl]butanamide IUPAC Name: 3-methyl-N-[(3-phenylpropanoylamino)carbamothioyl]butanamide Traditional Name: N-[(hydrocinnamoylamino)thiocarbamoyl]-3-methyl-butyramide Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NNC(=O)CCC1=CC=CC=C1

Isomeric SMILES

CC(C)CC(=O)NC(=S)NNC(=O)CCC1=CC=CC=C1

InChI

InChI=1S/C15H21N3O2S/c1-11(2)10-14(20)16-15(21)18-17-13(19)9-8-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3,(H,17,19)(H2,16,18,20,21)