N-[6-(4-azanyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)-1,3-benzothiazol-2-yl]cyclopropanecarboxamide

Systemtic Name: N-[6-(4-azanyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)-1,3-benzothiazol-2-yl]cyclopropanecarboxamide Openeye Name: N-[6-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidin-5-yl)-1,3-benzothiazol-2-yl]cyclopropanecarboxamide CAS Name: N-[6-(4-amino-7-propan-2-yl-5-pyrrolo[2,3-d]pyrimidinyl)-1,3-benzothiazol-2-yl]cyclopropanecarboxamide IUPAC Name: N-[6-(4-amino-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-5-yl)-1,3-benzothiazol-2-yl]cyclopropanecarboxamide Traditional Name: N-[6-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidin-5-yl)-1,3-benzothiazol-2-yl]cyclopropanecarboxamide Formula: C20H20N6OS MolecularWeight: 392.4774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C2=C1N=CN=C2N)C3=CC4=C(C=C3)N=C(S4)NC(=O)C5CC5

Isomeric SMILES

CC(C)N1C=C(C2=C1N=CN=C2N)C3=CC4=C(C=C3)N=C(S4)NC(=O)C5CC5

InChI

InChI=1S/C20H20N6OS/c1-10(2)26-8-13(16-17(21)22-9-23-18(16)26)12-5-6-14-15(7-12)28-20(24-14)25-19(27)11-3-4-11/h5-11H,3-4H2,1-2H3,(H2,21,22,23)(H,24,25,27)