2-[[(2,6-dimethylphenyl)carbamothioylamino]methylidene]propanediamide

Systemtic Name: 2-[[(2,6-dimethylphenyl)carbamothioylamino]methylidene]propanediamide Openeye Name: 2-[[(2,6-dimethylphenyl)carbamothioylamino]methylene]propanediamide CAS Name: 2-[[[(2,6-dimethylanilino)-sulfanylidenemethyl]amino]methylidene]propanediamide IUPAC Name: 2-[[(2,6-dimethylphenyl)carbamothioylamino]methylidene]propanediamide Traditional Name: 2-[[(2,6-dimethylphenyl)thiocarbamoylamino]methylene]malonamide Formula: C13H16N4O2S MolecularWeight: 292.35674

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N4O2S/c1-7-4-3-5-8(2)10(7)17-13(20)16-6-9(11(14)18)12(15)19/h3-6H,1-2H3,(H2,14,18)(H2,15,19)(H2,16,17,20)