N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-[2-[(1-methyl-2-imidazolyl)thio]ethyl]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-[2-(1-methylimidazol-2-yl)sulfanylethyl]-1-phenylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: 2-[(1-methylimidazol-2-yl)thio]ethyl-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C17H17N7S MolecularWeight: 351.42878

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCCNC2=NC=NC3=C2C=NN3C4=CC=CC=C4

Isomeric SMILES

CN1C=CN=C1SCCNC2=NC=NC3=C2C=NN3C4=CC=CC=C4

InChI

InChI=1S/C17H17N7S/c1-23-9-7-19-17(23)25-10-8-18-15-14-11-22-24(16(14)21-12-20-15)13-5-3-2-4-6-13/h2-7,9,11-12H,8,10H2,1H3,(H,18,20,21)