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

Systemtic Name: N-[6-(4-azanyl-7-propan-2-yl-pyrrolo[2,3-d]pyrimidin-5-yl)-1,3-benzothiazol-2-yl]ethanamide Openeye Name: N-[6-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidin-5-yl)-1,3-benzothiazol-2-yl]acetamide CAS Name: N-[6-(4-amino-7-propan-2-yl-5-pyrrolo[2,3-d]pyrimidinyl)-1,3-benzothiazol-2-yl]acetamide IUPAC Name: N-[6-(4-amino-7-propan-2-ylpyrrolo[2,3-d]pyrimidin-5-yl)-1,3-benzothiazol-2-yl]acetamide Traditional Name: N-[6-(4-amino-7-isopropyl-pyrrolo[2,3-d]pyrimidin-5-yl)-1,3-benzothiazol-2-yl]acetamide Formula: C18H18N6OS MolecularWeight: 366.44012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N6OS/c1-9(2)24-7-12(15-16(19)20-8-21-17(15)24)11-4-5-13-14(6-11)26-18(23-13)22-10(3)25/h4-9H,1-3H3,(H2,19,20,21)(H,22,23,25)