N-[6-(4-azanyl-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-3-yl)-1,3-benzothiazol-2-yl]ethanamide

Systemtic Name: N-[6-(4-azanyl-1-propan-2-yl-pyrazolo[3,4-d]pyrimidin-3-yl)-1,3-benzothiazol-2-yl]ethanamide Openeye Name: N-[6-(4-amino-1-isopropyl-pyrazolo[3,4-d]pyrimidin-3-yl)-1,3-benzothiazol-2-yl]acetamide CAS Name: N-[6-(4-amino-1-propan-2-yl-3-pyrazolo[3,4-d]pyrimidinyl)-1,3-benzothiazol-2-yl]acetamide IUPAC Name: N-[6-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)-1,3-benzothiazol-2-yl]acetamide Traditional Name: N-[6-(4-amino-1-isopropyl-pyrazolo[3,4-d]pyrimidin-3-yl)-1,3-benzothiazol-2-yl]acetamide Formula: C17H17N7OS MolecularWeight: 367.42818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C(=N1)C3=CC4=C(C=C3)N=C(S4)NC(=O)C)C(=NC=N2)N

Isomeric SMILES

CC(C)N1C2=C(C(=N1)C3=CC4=C(C=C3)N=C(S4)NC(=O)C)C(=NC=N2)N

InChI

InChI=1S/C17H17N7OS/c1-8(2)24-16-13(15(18)19-7-20-16)14(23-24)10-4-5-11-12(6-10)26-17(22-11)21-9(3)25/h4-8H,1-3H3,(H2,18,19,20)(H,21,22,25)