N-[6-azanyl-2-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]furan-2-carboxamide

Systemtic Name: N-[6-azanyl-2-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]furan-2-carboxamide Openeye Name: N-[6-amino-2-[2-(methylamino)-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]furan-2-carboxamide CAS Name: N-[6-amino-2-[[2-(methylamino)-2-oxoethyl]thio]-4-oxo-1H-pyrimidin-5-yl]-2-furancarboxamide IUPAC Name: N-[6-amino-2-[2-(methylamino)-2-oxoethyl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]furan-2-carboxamide Traditional Name: N-[6-amino-4-keto-2-[[2-keto-2-(methylamino)ethyl]thio]-1H-pyrimidin-5-yl]-2-furamide Formula: C12H13N5O4S MolecularWeight: 323.32772

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=CO2

Isomeric SMILES

CNC(=O)CSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=CO2

InChI

InChI=1S/C12H13N5O4S/c1-14-7(18)5-22-12-16-9(13)8(11(20)17-12)15-10(19)6-3-2-4-21-6/h2-4H,5H2,1H3,(H,14,18)(H,15,19)(H3,13,16,17,20)