7-chloranyl-3-propan-2-yl-5-propoxy-imidazo[1,5-c]pyrimidine; sulfuric acid

Systemtic Name: 7-chloranyl-3-propan-2-yl-5-propoxy-imidazo[1,5-c]pyrimidine; sulfuric acid Openeye Name: 7-chloro-3-isopropyl-5-propoxy-imidazo[1,5-c]pyrimidine; sulfuric acid CAS Name: 7-chloro-3-propan-2-yl-5-propoxyimidazo[1,5-c]pyrimidine; sulfuric acid IUPAC Name: 7-chloro-3-propan-2-yl-5-propoxyimidazo[1,5-c]pyrimidine; sulfuric acid Traditional Name: 7-chloro-3-isopropyl-5-propoxy-imidazo[1,5-c]pyrimidine; sulfuric acid Formula: C12H20ClN3O9S2 MolecularWeight: 449.8849

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NC(=CC2=CN=C(N21)C(C)C)Cl.OS(=O)(=O)O.OS(=O)(=O)O

Isomeric SMILES

CCCOC1=NC(=CC2=CN=C(N21)C(C)C)Cl.OS(=O)(=O)O.OS(=O)(=O)O

InChI

InChI=1S/C12H16ClN3O.2H2O4S/c1-4-5-17-12-15-10(13)6-9-7-14-11(8(2)3)16(9)12;2*1-5(2,3)4/h6-8H,4-5H2,1-3H3;2*(H2,1,2,3,4)