1-ethyl-3-methyl-6-[5-(4-methyl-1,3-thiazol-2-yl)-2-propoxy-phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-ethyl-3-methyl-6-[5-(4-methyl-1,3-thiazol-2-yl)-2-propoxy-phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-ethyl-3-methyl-6-[5-(4-methylthiazol-2-yl)-2-propoxy-phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-ethyl-3-methyl-6-[5-(4-methyl-2-thiazolyl)-2-propoxyphenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-ethyl-3-methyl-6-[5-(4-methyl-1,3-thiazol-2-yl)-2-propoxyphenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-ethyl-3-methyl-6-[5-(4-methylthiazol-2-yl)-2-propoxy-phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2=NC(=CS2)C)C3=NC(=O)C4=C(NN(C4=N3)CC)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2=NC(=CS2)C)C3=NC(=O)C4=C(NN(C4=N3)CC)C

InChI

InChI=1S/C21H23N5O2S/c1-5-9-28-16-8-7-14(21-22-12(3)11-29-21)10-15(16)18-23-19-17(20(27)24-18)13(4)25-26(19)6-2/h7-8,10-11,25H,5-6,9H2,1-4H3