N-[[2-(propanoylcarbamothioylamino)pyridin-3-yl]carbamothioyl]propanamide

Systemtic Name: N-[[2-(propanoylcarbamothioylamino)pyridin-3-yl]carbamothioyl]propanamide Openeye Name: N-[[2-(propanoylcarbamothioylamino)-3-pyridyl]carbamothioyl]propanamide CAS Name: N-[[[2-[[(1-oxopropylamino)-sulfanylidenemethyl]amino]-3-pyridinyl]amino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[[2-(propanoylcarbamothioylamino)pyridin-3-yl]carbamothioyl]propanamide Traditional Name: N-[[2-(propionylthiocarbamoylamino)-3-pyridyl]thiocarbamoyl]propionamide Formula: C13H17N5O2S2 MolecularWeight: 339.43638

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=C(N=CC=C1)NC(=S)NC(=O)CC

Isomeric SMILES

CCC(=O)NC(=S)NC1=C(N=CC=C1)NC(=S)NC(=O)CC

InChI

InChI=1S/C13H17N5O2S2/c1-3-9(19)16-12(21)15-8-6-5-7-14-11(8)18-13(22)17-10(20)4-2/h5-7H,3-4H2,1-2H3,(H2,15,16,19,21)(H2,14,17,18,20,22)