[3-[[2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]amino]phenyl]methyl thiocyanate

Systemtic Name: [3-[[2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]amino]phenyl]methyl thiocyanate Openeye Name: [3-[(2,4-dioxo-1H-pyrimidin-6-yl)amino]phenyl]methyl thiocyanate CAS Name: thiocyanic acid [3-[(2,4-dioxo-1H-pyrimidin-6-yl)amino]phenyl]methyl ester IUPAC Name: [3-[(2,4-dioxo-1H-pyrimidin-6-yl)amino]phenyl]methyl thiocyanate Traditional Name: thiocyanic acid [3-[(2,4-diketo-1H-pyrimidin-6-yl)amino]benzyl] ester Formula: C12H10N4O2S MolecularWeight: 274.2984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=CC(=O)NC(=O)N2)CSC#N

Isomeric SMILES

C1=CC(=CC(=C1)NC2=CC(=O)NC(=O)N2)CSC#N

InChI

InChI=1S/C12H10N4O2S/c13-7-19-6-8-2-1-3-9(4-8)14-10-5-11(17)16-12(18)15-10/h1-5H,6H2,(H3,14,15,16,17,18)