N'-oxidanyl-3-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanylmethyl]benzenecarboximidamide

Systemtic Name: N'-oxidanyl-3-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanylmethyl]benzenecarboximidamide Openeye Name: N'-hydroxy-3-[(6-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]benzamidine CAS Name: N'-hydroxy-3-[[(6-oxo-1H-pyrimidin-2-yl)thio]methyl]benzenecarboximidamide IUPAC Name: N'-hydroxy-3-[(6-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]benzenecarboximidamide Traditional Name: N'-hydroxy-3-[[(6-keto-1H-pyrimidin-2-yl)thio]methyl]benzamidine Formula: C12H12N4O2S MolecularWeight: 276.31428

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CSC2=NC=CC(=O)N2)C(=NO)N

Isomeric SMILES

C1=CC(=CC(=C1)CSC2=NC=CC(=O)N2)/C(=N/O)/N

InChI

InChI=1S/C12H12N4O2S/c13-11(16-18)9-3-1-2-8(6-9)7-19-12-14-5-4-10(17)15-12/h1-6,18H,7H2,(H2,13,16)(H,14,15,17)