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

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-(6-methyl-4-oxidanylidene-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide Openeye Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-(6-methyl-4-oxo-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-(6-methyl-4-oxo-1-phenyl-5-pyrazolo[3,4-d]pyrimidinyl)propanamide IUPAC Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-(6-methyl-4-oxo-1-phenylpyrazolo[3,4-d]pyrimidin-5-yl)propanamide Traditional Name: 3-(4-keto-6-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(4-methyl-1,3-benzothiazol-2-yl)propionamide Formula: C23H20N6O2S MolecularWeight: 444.5089

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CCN3C(=NC4=C(C3=O)C=NN4C5=CC=CC=C5)C

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CCN3C(=NC4=C(C3=O)C=NN4C5=CC=CC=C5)C

InChI

InChI=1S/C23H20N6O2S/c1-14-7-6-10-18-20(14)27-23(32-18)26-19(30)11-12-28-15(2)25-21-17(22(28)31)13-24-29(21)16-8-4-3-5-9-16/h3-10,13H,11-12H2,1-2H3,(H,26,27,30)