2-ethoxy-N-[2-[6-ethylsulfanyl-4-(propylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]pyridine-3-carboxamide

Systemtic Name: 2-ethoxy-N-[2-[6-ethylsulfanyl-4-(propylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]pyridine-3-carboxamide Openeye Name: 2-ethoxy-N-[2-[6-ethylsulfanyl-4-(propylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]pyridine-3-carboxamide CAS Name: 2-ethoxy-N-[2-[6-(ethylthio)-4-(propylamino)-1-pyrazolo[3,4-d]pyrimidinyl]ethyl]-3-pyridinecarboxamide IUPAC Name: 2-ethoxy-N-[2-[6-ethylsulfanyl-4-(propylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]pyridine-3-carboxamide Traditional Name: 2-ethoxy-N-[2-[6-(ethylthio)-4-(propylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]nicotinamide Formula: C20H27N7O2S MolecularWeight: 429.53908

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC(=NC2=C1C=NN2CCNC(=O)C3=C(N=CC=C3)OCC)SCC

Isomeric SMILES

CCCNC1=NC(=NC2=C1C=NN2CCNC(=O)C3=C(N=CC=C3)OCC)SCC

InChI

InChI=1S/C20H27N7O2S/c1-4-9-21-16-15-13-24-27(17(15)26-20(25-16)30-6-3)12-11-22-18(28)14-8-7-10-23-19(14)29-5-2/h7-8,10,13H,4-6,9,11-12H2,1-3H3,(H,22,28)(H,21,25,26)