3-methyl-N-[(2-phenylethanoylamino)carbamothioyl]butanamide

Systemtic Name: 3-methyl-N-[(2-phenylethanoylamino)carbamothioyl]butanamide Openeye Name: 3-methyl-N-[[(2-phenylacetyl)amino]carbamothioyl]butanamide CAS Name: 3-methyl-N-[[(1-oxo-2-phenylethyl)hydrazo]-sulfanylidenemethyl]butanamide IUPAC Name: 3-methyl-N-[[(2-phenylacetyl)amino]carbamothioyl]butanamide Traditional Name: 3-methyl-N-[[(2-phenylacetyl)amino]thiocarbamoyl]butyramide Formula: C14H19N3O2S MolecularWeight: 293.38456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O2S/c1-10(2)8-12(18)15-14(20)17-16-13(19)9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3,(H,16,19)(H2,15,17,18,20)