2-[4-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-3-methyl-thiophen-2-yl]ethyl phosphono hydrogen phosphate

Systemtic Name: 2-[4-[(4-azanyl-2-methyl-pyrimidin-5-yl)methyl]-3-methyl-thiophen-2-yl]ethyl phosphono hydrogen phosphate Openeye Name: 2-[4-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-3-methyl-2-thienyl]ethyl phosphono hydrogen phosphate CAS Name: 2-[4-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-3-methyl-2-thiophenyl]ethyl phosphono hydrogen phosphate IUPAC Name: 2-[4-[(4-amino-2-methylpyrimidin-5-yl)methyl]-3-methylthiophen-2-yl]ethyl phosphono hydrogen phosphate Traditional Name: 2-[4-[(4-amino-2-methyl-pyrimidin-5-yl)methyl]-3-methyl-2-thienyl]ethyl phosphono hydrogen phosphate Formula: C13H19N3O7P2S MolecularWeight: 423.318382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1CC2=CN=C(N=C2N)C)CCOP(=O)(O)OP(=O)(O)O

Isomeric SMILES

CC1=C(SC=C1CC2=CN=C(N=C2N)C)CCOP(=O)(O)OP(=O)(O)O

InChI

InChI=1S/C13H19N3O7P2S/c1-8-11(5-10-6-15-9(2)16-13(10)14)7-26-12(8)3-4-22-25(20,21)23-24(17,18)19/h6-7H,3-5H2,1-2H3,(H,20,21)(H2,14,15,16)(H2,17,18,19)