2-methyl-3-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]quinoxaline

Systemtic Name: 2-methyl-3-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]quinoxaline Openeye Name: 2-methyl-3-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]quinoxaline CAS Name: 2-methyl-3-[[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]methyl]quinoxaline IUPAC Name: 2-methyl-3-[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]quinoxaline Traditional Name: 2-methyl-3-[[(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)thio]methyl]quinoxaline Formula: C21H16N6S MolecularWeight: 384.45694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1CSC3=NC=NC4=C3C=NN4C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1CSC3=NC=NC4=C3C=NN4C5=CC=CC=C5

InChI

InChI=1S/C21H16N6S/c1-14-19(26-18-10-6-5-9-17(18)25-14)12-28-21-16-11-24-27(20(16)22-13-23-21)15-7-3-2-4-8-15/h2-11,13H,12H2,1H3