N-[(3-chlorophenyl)methyl]-N-methyl-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-N-methyl-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide Openeye Name: N-[(3-chlorophenyl)methyl]-N-methyl-3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: N-[(3-chlorophenyl)methyl]-N-methyl-3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)propanamide IUPAC Name: N-[(3-chlorophenyl)methyl]-N-methyl-3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)propanamide Traditional Name: N-(3-chlorobenzyl)-3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)-N-methyl-propionamide Formula: C17H18ClN5O2 MolecularWeight: 359.81012

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CCC(=O)N(C)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CCC(=O)N(C)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C17H18ClN5O2/c1-21(10-12-4-3-5-13(18)8-12)15(24)6-7-23-11-19-16-14(17(23)25)9-20-22(16)2/h3-5,8-9,11H,6-7,10H2,1-2H3