S-ethyl N-(pyridin-4-ylcarbonylamino)carbamothioate

Systemtic Name: S-ethyl N-(pyridin-4-ylcarbonylamino)carbamothioate Openeye Name: S-ethyl N-(pyridine-4-carbonylamino)carbamothioate CAS Name: N-[[oxo(pyridin-4-yl)methyl]amino]carbamothioic acid S-ethyl ester IUPAC Name: S-ethyl N-(pyridine-4-carbonylamino)carbamothioate Traditional Name: N-isonicotinamidothiocarbamic acid S-ethyl ester Formula: C9H11N3O2S MolecularWeight: 225.26754

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)NNC(=O)C1=CC=NC=C1

Isomeric SMILES

CCSC(=O)NNC(=O)C1=CC=NC=C1

InChI

InChI=1S/C9H11N3O2S/c1-2-15-9(14)12-11-8(13)7-3-5-10-6-4-7/h3-6H,2H2,1H3,(H,11,13)(H,12,14)