N-[4-(4-azanyl-1-piperidin-4-yl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxy-phenyl]-4-methoxy-1H-indole-2-carboxamide

Systemtic Name: N-[4-(4-azanyl-1-piperidin-4-yl-pyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxy-phenyl]-4-methoxy-1H-indole-2-carboxamide Openeye Name: N-[4-[4-amino-1-(4-piperidyl)pyrazolo[3,4-d]pyrimidin-3-yl]-2-methoxy-phenyl]-4-methoxy-1H-indole-2-carboxamide CAS Name: N-[4-[4-amino-1-(4-piperidinyl)-3-pyrazolo[3,4-d]pyrimidinyl]-2-methoxyphenyl]-4-methoxy-1H-indole-2-carboxamide IUPAC Name: N-[4-(4-amino-1-piperidin-4-ylpyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxyphenyl]-4-methoxy-1H-indole-2-carboxamide Traditional Name: N-[4-[4-amino-1-(4-piperidyl)pyrazolo[3,4-d]pyrimidin-3-yl]-2-methoxy-phenyl]-4-methoxy-1H-indole-2-carboxamide Formula: C27H28N8O3 MolecularWeight: 512.56302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C=C(N2)C(=O)NC3=C(C=C(C=C3)C4=NN(C5=C4C(=NC=N5)N)C6CCNCC6)OC

Isomeric SMILES

COC1=CC=CC2=C1C=C(N2)C(=O)NC3=C(C=C(C=C3)C4=NN(C5=C4C(=NC=N5)N)C6CCNCC6)OC

InChI

InChI=1S/C27H28N8O3/c1-37-21-5-3-4-18-17(21)13-20(32-18)27(36)33-19-7-6-15(12-22(19)38-2)24-23-25(28)30-14-31-26(23)35(34-24)16-8-10-29-11-9-16/h3-7,12-14,16,29,32H,8-11H2,1-2H3,(H,33,36)(H2,28,30,31)