3-[(6-azanyl-1-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-N,4-dimethyl-benzamide

Systemtic Name: 3-[(6-azanyl-1-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-N,4-dimethyl-benzamide Openeye Name: 3-[(6-amino-1-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-N,4-dimethyl-benzamide CAS Name: 3-[(6-amino-1-propyl-4-pyrazolo[3,4-d]pyrimidinyl)amino]-N,4-dimethylbenzamide IUPAC Name: 3-[(6-amino-1-propylpyrazolo[3,4-d]pyrimidin-4-yl)amino]-N,4-dimethylbenzamide Traditional Name: 3-[(6-amino-1-propyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-N,4-dimethyl-benzamide Formula: C17H21N7O MolecularWeight: 339.39494

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=N1)C(=NC(=N2)N)NC3=C(C=CC(=C3)C(=O)NC)C

Isomeric SMILES

CCCN1C2=C(C=N1)C(=NC(=N2)N)NC3=C(C=CC(=C3)C(=O)NC)C

InChI

InChI=1S/C17H21N7O/c1-4-7-24-15-12(9-20-24)14(22-17(18)23-15)21-13-8-11(16(25)19-3)6-5-10(13)2/h5-6,8-9H,4,7H2,1-3H3,(H,19,25)(H3,18,21,22,23)