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

Systemtic Name: 2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]pyrimidine-4,6-diamine Openeye Name: 2-[[5-(2-thienyl)isoxazol-3-yl]methylsulfanyl]pyrimidine-4,6-diamine CAS Name: 2-[(5-thiophen-2-yl-3-isoxazolyl)methylthio]pyrimidine-4,6-diamine IUPAC Name: 2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]pyrimidine-4,6-diamine Traditional Name: [6-amino-2-[[5-(2-thienyl)isoxazol-3-yl]methylthio]pyrimidin-4-yl]amine Formula: C12H11N5OS2 MolecularWeight: 305.37864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11N5OS2/c13-10-5-11(14)16-12(15-10)20-6-7-4-8(18-17-7)9-2-1-3-19-9/h1-5H,6H2,(H4,13,14,15,16)