4-[1-ethyl-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]benzimidazol-5-yl]sulfonylmorpholine

Systemtic Name: 4-[1-ethyl-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]benzimidazol-5-yl]sulfonylmorpholine Openeye Name: 4-[1-ethyl-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]benzimidazol-5-yl]sulfonylmorpholine CAS Name: 4-[[1-ethyl-2-[[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]methyl]-5-benzimidazolyl]sulfonyl]morpholine IUPAC Name: 4-[1-ethyl-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]benzimidazol-5-yl]sulfonylmorpholine Traditional Name: 4-[1-ethyl-2-[[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]methyl]benzimidazol-5-yl]sulfonylmorpholine Formula: C20H23N7O3S2 MolecularWeight: 473.57172

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NC=NC5=C4C=NN5C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC4=NC=NC5=C4C=NN5C

InChI

InChI=1S/C20H23N7O3S2/c1-3-27-17-5-4-14(32(28,29)26-6-8-30-9-7-26)10-16(17)24-18(27)12-31-20-15-11-23-25(2)19(15)21-13-22-20/h4-5,10-11,13H,3,6-9,12H2,1-2H3