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

Systemtic Name: 3-(1-tert-butyl-6-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-(1-tert-butyl-6-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-(1-tert-butyl-6-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(1-tert-butyl-6-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-(1-tert-butyl-4-keto-6-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(6-ethoxy-1,3-benzothiazol-2-yl)propionamide Formula: C22H26N6O3S MolecularWeight: 454.54524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCN3C(=NC4=C(C3=O)C=NN4C(C)(C)C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCN3C(=NC4=C(C3=O)C=NN4C(C)(C)C)C

InChI

InChI=1S/C22H26N6O3S/c1-6-31-14-7-8-16-17(11-14)32-21(25-16)26-18(29)9-10-27-13(2)24-19-15(20(27)30)12-23-28(19)22(3,4)5/h7-8,11-12H,6,9-10H2,1-5H3,(H,25,26,29)