N-(1-tert-butyl-3-naphthalen-2-yl-pyrazolo[3,4-d]pyrimidin-4-yl)prop-2-enamide

Systemtic Name: N-(1-tert-butyl-3-naphthalen-2-yl-pyrazolo[3,4-d]pyrimidin-4-yl)prop-2-enamide Openeye Name: N-[1-tert-butyl-3-(2-naphthyl)pyrazolo[3,4-d]pyrimidin-4-yl]prop-2-enamide CAS Name: N-[1-tert-butyl-3-(2-naphthalenyl)-4-pyrazolo[3,4-d]pyrimidinyl]-2-propenamide IUPAC Name: N-(1-tert-butyl-3-naphthalen-2-ylpyrazolo[3,4-d]pyrimidin-4-yl)prop-2-enamide Traditional Name: N-[1-tert-butyl-3-(2-naphthyl)pyrazolo[3,4-d]pyrimidin-4-yl]acrylamide Formula: C22H21N5O MolecularWeight: 371.43504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C2=C(C(=N1)C3=CC4=CC=CC=C4C=C3)C(=NC=N2)NC(=O)C=C

Isomeric SMILES

CC(C)(C)N1C2=C(C(=N1)C3=CC4=CC=CC=C4C=C3)C(=NC=N2)NC(=O)C=C

InChI

InChI=1S/C22H21N5O/c1-5-17(28)25-20-18-19(16-11-10-14-8-6-7-9-15(14)12-16)26-27(22(2,3)4)21(18)24-13-23-20/h5-13H,1H2,2-4H3,(H,23,24,25,28)