N-[(pyridin-4-ylcarbonylamino)carbamothioyl]pentanamide

Systemtic Name: N-[(pyridin-4-ylcarbonylamino)carbamothioyl]pentanamide Openeye Name: N-[(pyridine-4-carbonylamino)carbamothioyl]pentanamide CAS Name: N-[[[oxo(pyridin-4-yl)methyl]hydrazo]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[(pyridine-4-carbonylamino)carbamothioyl]pentanamide Traditional Name: N-(isonicotinamidothiocarbamoyl)valeramide Formula: C12H16N4O2S MolecularWeight: 280.34604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NNC(=O)C1=CC=NC=C1

Isomeric SMILES

CCCCC(=O)NC(=S)NNC(=O)C1=CC=NC=C1

InChI

InChI=1S/C12H16N4O2S/c1-2-3-4-10(17)14-12(19)16-15-11(18)9-5-7-13-8-6-9/h5-8H,2-4H2,1H3,(H,15,18)(H2,14,16,17,19)