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

Systemtic Name: 3-(1-tert-butyl-6-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-chloranyl-2-methoxy-phenyl)propanamide Openeye Name: 3-(1-tert-butyl-6-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-chloro-2-methoxy-phenyl)propanamide CAS Name: 3-(1-tert-butyl-6-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)-N-(5-chloro-2-methoxyphenyl)propanamide IUPAC Name: 3-(1-tert-butyl-6-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-chloro-2-methoxyphenyl)propanamide Traditional Name: 3-(1-tert-butyl-4-keto-6-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-(5-chloro-2-methoxy-phenyl)propionamide Formula: C20H24ClN5O3 MolecularWeight: 417.88926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2C(C)(C)C)C(=O)N1CCC(=O)NC3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC1=NC2=C(C=NN2C(C)(C)C)C(=O)N1CCC(=O)NC3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C20H24ClN5O3/c1-12-23-18-14(11-22-26(18)20(2,3)4)19(28)25(12)9-8-17(27)24-15-10-13(21)6-7-16(15)29-5/h6-7,10-11H,8-9H2,1-5H3,(H,24,27)