2-(4-methylphenyl)-4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-1,3-oxazole

Systemtic Name: 2-(4-methylphenyl)-4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-1,3-oxazole Openeye Name: 4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-2-(p-tolyl)oxazole CAS Name: 2-(4-methylphenyl)-4-[[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]methyl]oxazole IUPAC Name: 2-(4-methylphenyl)-4-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-1,3-oxazole Traditional Name: 4-[[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]methyl]-2-(p-tolyl)oxazole Formula: C22H17N5OS MolecularWeight: 399.46828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CO2)CSC3=NC=NC4=C3C=NN4C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CO2)CSC3=NC=NC4=C3C=NN4C5=CC=CC=C5

InChI

InChI=1S/C22H17N5OS/c1-15-7-9-16(10-8-15)21-26-17(12-28-21)13-29-22-19-11-25-27(20(19)23-14-24-22)18-5-3-2-4-6-18/h2-12,14H,13H2,1H3