2-[(2S)-1-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)pyrrolidin-2-yl]-1,3-benzothiazole

Systemtic Name: 2-[(2S)-1-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)pyrrolidin-2-yl]-1,3-benzothiazole Openeye Name: 2-[(2S)-1-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)pyrrolidin-2-yl]-1,3-benzothiazole CAS Name: 2-[(2S)-1-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-2-pyrrolidinyl]-1,3-benzothiazole IUPAC Name: 2-[(2S)-1-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)pyrrolidin-2-yl]-1,3-benzothiazole Traditional Name: 2-[(2S)-1-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)pyrrolidin-2-yl]-1,3-benzothiazole Formula: C17H16N6S MolecularWeight: 336.41414

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCCC3C4=NC5=CC=CC=C5S4

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCC[C@H]3C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C17H16N6S/c1-22-15-11(9-20-22)16(19-10-18-15)23-8-4-6-13(23)17-21-12-5-2-3-7-14(12)24-17/h2-3,5,7,9-10,13H,4,6,8H2,1H3/t13-/m0/s1