N-[2-[(1-phenyl-6-propan-2-yl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[(1-phenyl-6-propan-2-yl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[(6-isopropyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl]thiophene-2-carboxamide CAS Name: N-[2-[(1-phenyl-6-propan-2-yl-4-pyrazolo[3,4-d]pyrimidinyl)amino]ethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[(1-phenyl-6-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl]thiophene-2-carboxamide Traditional Name: N-[2-[(6-isopropyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]ethyl]thiophene-2-carboxamide Formula: C21H22N6OS MolecularWeight: 406.50398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)NCCNC(=O)C4=CC=CS4

Isomeric SMILES

CC(C)C1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)NCCNC(=O)C4=CC=CS4

InChI

InChI=1S/C21H22N6OS/c1-14(2)18-25-19(22-10-11-23-21(28)17-9-6-12-29-17)16-13-24-27(20(16)26-18)15-7-4-3-5-8-15/h3-9,12-14H,10-11H2,1-2H3,(H,23,28)(H,22,25,26)