1-cyclopentyl-3-(4-thiophen-3-yloxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-cyclopentyl-3-(4-thiophen-3-yloxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-cyclopentyl-3-[4-(3-thienyloxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-cyclopentyl-3-[4-(3-thiophenyloxy)phenyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-cyclopentyl-3-(4-thiophen-3-yloxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-cyclopentyl-3-[4-(3-thienyloxy)phenyl]pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C20H19N5OS MolecularWeight: 377.46276

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C3=C(C(=N2)C4=CC=C(C=C4)OC5=CSC=C5)C(=NC=N3)N

Isomeric SMILES

C1CCC(C1)N2C3=C(C(=N2)C4=CC=C(C=C4)OC5=CSC=C5)C(=NC=N3)N

InChI

InChI=1S/C20H19N5OS/c21-19-17-18(13-5-7-15(8-6-13)26-16-9-10-27-11-16)24-25(14-3-1-2-4-14)20(17)23-12-22-19/h5-12,14H,1-4H2,(H2,21,22,23)