1-(furan-2-ylmethyl)-3-[2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)ethanoylamino]thiourea

Systemtic Name: 1-(furan-2-ylmethyl)-3-[2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)ethanoylamino]thiourea Openeye Name: 1-(2-furylmethyl)-3-[[2-(4-oxo-2-thioxo-1H-pyrimidin-6-yl)acetyl]amino]thiourea CAS Name: 1-(2-furanylmethyl)-3-[[1-oxo-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)ethyl]amino]thiourea IUPAC Name: 1-(furan-2-ylmethyl)-3-[[2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)acetyl]amino]thiourea Traditional Name: 1-(2-furfuryl)-3-[[2-(4-keto-2-thioxo-1H-pyrimidin-6-yl)acetyl]amino]thiourea Formula: C12H13N5O3S2 MolecularWeight: 339.39332

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=S)NNC(=O)CC2=CC(=O)NC(=S)N2

Isomeric SMILES

C1=COC(=C1)CNC(=S)NNC(=O)CC2=CC(=O)NC(=S)N2

InChI

InChI=1S/C12H13N5O3S2/c18-9-4-7(14-12(22)15-9)5-10(19)16-17-11(21)13-6-8-2-1-3-20-8/h1-4H,5-6H2,(H,16,19)(H2,13,17,21)(H2,14,15,18,22)