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

Systemtic Name: 1,3-dimethyl-6-(2-propoxy-5-thiophen-2-yl-phenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1,3-dimethyl-6-[2-propoxy-5-(2-thienyl)phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1,3-dimethyl-6-(2-propoxy-5-thiophen-2-ylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 1,3-dimethyl-6-(2-propoxy-5-thiophen-2-ylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1,3-dimethyl-6-[2-propoxy-5-(2-thienyl)phenyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N4O2S/c1-4-9-26-15-8-7-13(16-6-5-10-27-16)11-14(15)18-21-19-17(20(25)22-18)12(2)23-24(19)3/h5-8,10-11,23H,4,9H2,1-3H3