2-(4-bromophenyl)-N-[(1-propan-2-yl-6-thiophen-3-yl-pyrazolo[3,4-b]pyridin-5-yl)methyl]ethanamine

Systemtic Name: 2-(4-bromophenyl)-N-[(1-propan-2-yl-6-thiophen-3-yl-pyrazolo[3,4-b]pyridin-5-yl)methyl]ethanamine Openeye Name: 2-(4-bromophenyl)-N-[[1-isopropyl-6-(3-thienyl)pyrazolo[3,4-b]pyridin-5-yl]methyl]ethanamine CAS Name: 2-(4-bromophenyl)-N-[[1-propan-2-yl-6-(3-thiophenyl)-5-pyrazolo[3,4-b]pyridinyl]methyl]ethanamine IUPAC Name: 2-(4-bromophenyl)-N-[(1-propan-2-yl-6-thiophen-3-ylpyrazolo[3,4-b]pyridin-5-yl)methyl]ethanamine Traditional Name: 2-(4-bromophenyl)ethyl-[[1-isopropyl-6-(3-thienyl)pyrazolo[3,4-b]pyridin-5-yl]methyl]amine Formula: C22H23BrN4S MolecularWeight: 455.41382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC(=C(C=C2C=N1)CNCCC3=CC=C(C=C3)Br)C4=CSC=C4

Isomeric SMILES

CC(C)N1C2=NC(=C(C=C2C=N1)CNCCC3=CC=C(C=C3)Br)C4=CSC=C4

InChI

InChI=1S/C22H23BrN4S/c1-15(2)27-22-19(13-25-27)11-18(21(26-22)17-8-10-28-14-17)12-24-9-7-16-3-5-20(23)6-4-16/h3-6,8,10-11,13-15,24H,7,9,12H2,1-2H3