N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide

Systemtic Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide Openeye Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(4-oxo-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(4-oxo-1-phenyl-5-pyrazolo[3,4-d]pyrimidinyl)propanamide IUPAC Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(4-oxo-1-phenylpyrazolo[3,4-d]pyrimidin-5-yl)propanamide Traditional Name: N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-(4-keto-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propionamide Formula: C23H20N6O3S MolecularWeight: 460.5083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5

InChI

InChI=1S/C23H20N6O3S/c1-2-32-16-8-9-18-19(12-16)33-23(26-18)27-20(30)10-11-28-14-24-21-17(22(28)31)13-25-29(21)15-6-4-3-5-7-15/h3-9,12-14H,2,10-11H2,1H3,(H,26,27,30)