3-(4-methylphenyl)-5-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-1,2-oxazole

Systemtic Name: 3-(4-methylphenyl)-5-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-1,2-oxazole Openeye Name: 5-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-3-(p-tolyl)isoxazole CAS Name: 3-(4-methylphenyl)-5-[[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]methyl]isoxazole IUPAC Name: 3-(4-methylphenyl)-5-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-1,2-oxazole Traditional Name: 5-[[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]methyl]-3-(p-tolyl)isoxazole Formula: C17H15N5OS MolecularWeight: 337.3989

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=C2)CSC3=NC=NC4=C3C=NN4C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=C2)CSC3=NC=NC4=C3C=NN4C

InChI

InChI=1S/C17H15N5OS/c1-11-3-5-12(6-4-11)15-7-13(23-21-15)9-24-17-14-8-20-22(2)16(14)18-10-19-17/h3-8,10H,9H2,1-2H3