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

Systemtic Name: 1-ethyl-3-methyl-6-[5-(2-methyl-1,3-thiazol-4-yl)-2-propoxy-phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-ethyl-3-methyl-6-[5-(2-methylthiazol-4-yl)-2-propoxy-phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-ethyl-3-methyl-6-[5-(2-methyl-4-thiazolyl)-2-propoxyphenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1-ethyl-3-methyl-6-[5-(2-methyl-1,3-thiazol-4-yl)-2-propoxyphenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-ethyl-3-methyl-6-[5-(2-methylthiazol-4-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=CSC(=N2)C)C3=NC(=O)C4=C(NN(C4=N3)CC)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2=CSC(=N2)C)C3=NC(=O)C4=C(NN(C4=N3)CC)C

InChI

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