2-[[(4-ethoxyphenyl)carbamothioylamino]methylidene]propanediamide

Systemtic Name: 2-[[(4-ethoxyphenyl)carbamothioylamino]methylidene]propanediamide Openeye Name: 2-[[(4-ethoxyphenyl)carbamothioylamino]methylene]propanediamide CAS Name: 2-[[[(4-ethoxyanilino)-sulfanylidenemethyl]amino]methylidene]propanediamide IUPAC Name: 2-[[(4-ethoxyphenyl)carbamothioylamino]methylidene]propanediamide Traditional Name: 2-[(p-phenetylthiocarbamoylamino)methylene]malonamide Formula: C13H16N4O3S MolecularWeight: 308.35614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NC=C(C(=O)N)C(=O)N

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NC=C(C(=O)N)C(=O)N

InChI

InChI=1S/C13H16N4O3S/c1-2-20-9-5-3-8(4-6-9)17-13(21)16-7-10(11(14)18)12(15)19/h3-7H,2H2,1H3,(H2,14,18)(H2,15,19)(H2,16,17,21)