2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]pyrimidine-4,6-diamine

Systemtic Name: 2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]pyrimidine-4,6-diamine Openeye Name: 2-[[5-(2-furyl)isoxazol-3-yl]methylsulfanyl]pyrimidine-4,6-diamine CAS Name: 2-[[5-(2-furanyl)-3-isoxazolyl]methylthio]pyrimidine-4,6-diamine IUPAC Name: 2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methylsulfanyl]pyrimidine-4,6-diamine Traditional Name: [6-amino-2-[[5-(2-furyl)isoxazol-3-yl]methylthio]pyrimidin-4-yl]amine Formula: C12H11N5O2S MolecularWeight: 289.31304

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=CC(=NO2)CSC3=NC(=CC(=N3)N)N

Isomeric SMILES

C1=COC(=C1)C2=CC(=NO2)CSC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C12H11N5O2S/c13-10-5-11(14)16-12(15-10)20-6-7-4-9(19-17-7)8-2-1-3-18-8/h1-5H,6H2,(H4,13,14,15,16)