1-(3,4-dihydro-2H-quinolin-1-yl)-2-(6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanone CAS Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-methyl-1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]ethanone IUPAC Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(6-methyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylethanone Traditional Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)thio]ethanone Formula: C23H21N5OS MolecularWeight: 415.51074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)SCC(=O)N4CCCC5=CC=CC=C54

Isomeric SMILES

CC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)SCC(=O)N4CCCC5=CC=CC=C54

InChI

InChI=1S/C23H21N5OS/c1-16-25-22-19(14-24-28(22)18-10-3-2-4-11-18)23(26-16)30-15-21(29)27-13-7-9-17-8-5-6-12-20(17)27/h2-6,8,10-12,14H,7,9,13,15H2,1H3