8-[[2,2-bis(2-chloroethyl)hydrazinyl]methylidene]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 8-[[2,2-bis(2-chloroethyl)hydrazinyl]methylidene]-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-[[2,2-bis(2-chloroethyl)hydrazino]methylene]-1,3-dimethyl-purine-2,6-dione CAS Name: 8-[[2,2-bis(2-chloroethyl)hydrazinyl]methylidene]-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-[[2,2-bis(2-chloroethyl)hydrazinyl]methylidene]-1,3-dimethylpurine-2,6-dione Traditional Name: 8-[[N',N'-bis(2-chloroethyl)hydrazino]methylene]-1,3-dimethyl-xanthine Formula: C12H16Cl2N6O2 MolecularWeight: 347.20044

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC(=CNN(CCCl)CCCl)N=C2C(=O)N(C1=O)C

Isomeric SMILES

CN1C2=NC(=CNN(CCCl)CCCl)N=C2C(=O)N(C1=O)C

InChI

InChI=1S/C12H16Cl2N6O2/c1-18-10-9(11(21)19(2)12(18)22)16-8(17-10)7-15-20(5-3-13)6-4-14/h7,15H,3-6H2,1-2H3