4-[(1,3-dimethyl-7-oxidanylidene-6-propyl-pyrazolo[4,3-d]pyrimidin-5-yl)amino]benzenecarbonitrile

Systemtic Name: 4-[(1,3-dimethyl-7-oxidanylidene-6-propyl-pyrazolo[4,3-d]pyrimidin-5-yl)amino]benzenecarbonitrile Openeye Name: 4-[(1,3-dimethyl-7-oxo-6-propyl-pyrazolo[4,3-d]pyrimidin-5-yl)amino]benzonitrile CAS Name: 4-[(1,3-dimethyl-7-oxo-6-propyl-5-pyrazolo[4,3-d]pyrimidinyl)amino]benzonitrile IUPAC Name: 4-[(1,3-dimethyl-7-oxo-6-propylpyrazolo[4,3-d]pyrimidin-5-yl)amino]benzonitrile Traditional Name: 4-[(7-keto-1,3-dimethyl-6-propyl-pyrazolo[4,3-d]pyrimidin-5-yl)amino]benzonitrile Formula: C17H18N6O MolecularWeight: 322.36442

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C(=NN2C)C)N=C1NC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCN1C(=O)C2=C(C(=NN2C)C)N=C1NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H18N6O/c1-4-9-23-16(24)15-14(11(2)21-22(15)3)20-17(23)19-13-7-5-12(10-18)6-8-13/h5-8H,4,9H2,1-3H3,(H,19,20)