3-(4-ethoxy-3-methoxy-phenyl)-1-prop-2-enyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 3-(4-ethoxy-3-methoxy-phenyl)-1-prop-2-enyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-allyl-3-(4-ethoxy-3-methoxy-phenyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 3-(4-ethoxy-3-methoxyphenyl)-1-prop-2-enyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 3-(4-ethoxy-3-methoxyphenyl)-1-prop-2-enylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-allyl-3-(4-ethoxy-3-methoxy-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C17H19N5O2 MolecularWeight: 325.36506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NN(C3=C2C(=NC=N3)N)CC=C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NN(C3=C2C(=NC=N3)N)CC=C)OC

InChI

InChI=1S/C17H19N5O2/c1-4-8-22-17-14(16(18)19-10-20-17)15(21-22)11-6-7-12(24-5-2)13(9-11)23-3/h4,6-7,9-10H,1,5,8H2,2-3H3,(H2,18,19,20)