5,6-bis(azanyl)-2-(5-chloranyl-2-propoxy-phenyl)-1H-pyrimidin-4-one; sulfuric acid

Systemtic Name: 5,6-bis(azanyl)-2-(5-chloranyl-2-propoxy-phenyl)-1H-pyrimidin-4-one; sulfuric acid Openeye Name: 5,6-diamino-2-(5-chloro-2-propoxy-phenyl)-1H-pyrimidin-4-one; sulfuric acid CAS Name: 5,6-diamino-2-(5-chloro-2-propoxyphenyl)-1H-pyrimidin-4-one; sulfuric acid IUPAC Name: 5,6-diamino-2-(5-chloro-2-propoxyphenyl)-1H-pyrimidin-4-one; sulfuric acid Traditional Name: 5,6-diamino-2-(5-chloro-2-propoxy-phenyl)-1H-pyrimidin-4-one; sulfuric acid Formula: C13H17ClN4O6S MolecularWeight: 392.81528

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Cl)C2=NC(=O)C(=C(N2)N)N.OS(=O)(=O)O

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Cl)C2=NC(=O)C(=C(N2)N)N.OS(=O)(=O)O

InChI

InChI=1S/C13H15ClN4O2.H2O4S/c1-2-5-20-9-4-3-7(14)6-8(9)12-17-11(16)10(15)13(19)18-12;1-5(2,3)4/h3-4,6H,2,5,15H2,1H3,(H3,16,17,18,19);(H2,1,2,3,4)