N-cyclopentyl-3-[(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methylcarbamoylamino]propanamide

Systemtic Name: N-cyclopentyl-3-[(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methylcarbamoylamino]propanamide Openeye Name: N-cyclopentyl-3-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methylcarbamoylamino]propanamide CAS Name: N-cyclopentyl-3-[[oxo-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methylamino]methyl]amino]propanamide IUPAC Name: N-cyclopentyl-3-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methylcarbamoylamino]propanamide Traditional Name: N-cyclopentyl-3-[(4-keto-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methylcarbamoylamino]propionamide Formula: C21H25N7O3 MolecularWeight: 423.4683

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)CCNC(=O)NCC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)NC(=O)CCNC(=O)NCC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

InChI

InChI=1S/C21H25N7O3/c29-18(25-14-6-4-5-7-14)10-11-22-21(31)23-13-17-26-19-16(20(30)27-17)12-24-28(19)15-8-2-1-3-9-15/h1-3,8-9,12,14,24H,4-7,10-11,13H2,(H,25,29)(H2,22,23,31)