S-aminocarbonyl N-[6-(aminocarbonylsulfanylcarbonylamino)pyridin-2-yl]carbamothioate

Systemtic Name: S-aminocarbonyl N-[6-(aminocarbonylsulfanylcarbonylamino)pyridin-2-yl]carbamothioate Openeye Name: S-carbamoyl N-[6-(carbamoylsulfanylcarbonylamino)-2-pyridyl]carbamothioate CAS Name: N-[6-[[(carbamoylthio)-oxomethyl]amino]-2-pyridinyl]carbamothioic acid S-carbamoyl ester IUPAC Name: S-carbamoyl N-[6-(carbamoylsulfanylcarbonylamino)pyridin-2-yl]carbamothioate Traditional Name: N-[6-[(carbamoylthio)carbonylamino]-2-pyridyl]thiocarbamic acid S-carbamoyl ester Formula: C9H9N5O4S2 MolecularWeight: 315.32886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC(=C1)NC(=O)SC(=O)N)NC(=O)SC(=O)N

Isomeric SMILES

C1=CC(=NC(=C1)NC(=O)SC(=O)N)NC(=O)SC(=O)N

InChI

InChI=1S/C9H9N5O4S2/c10-6(15)19-8(17)13-4-2-1-3-5(12-4)14-9(18)20-7(11)16/h1-3H,(H2,10,15)(H2,11,16)(H2,12,13,14,17,18)