4-[(1,3-dimethyl-7-oxidanylidene-6-propan-2-yl-pyrazolo[4,3-d]pyrimidin-5-yl)amino]benzenecarbonitrile

Systemtic Name: 4-[(1,3-dimethyl-7-oxidanylidene-6-propan-2-yl-pyrazolo[4,3-d]pyrimidin-5-yl)amino]benzenecarbonitrile Openeye Name: 4-[(6-isopropyl-1,3-dimethyl-7-oxo-pyrazolo[4,3-d]pyrimidin-5-yl)amino]benzonitrile CAS Name: 4-[(1,3-dimethyl-7-oxo-6-propan-2-yl-5-pyrazolo[4,3-d]pyrimidinyl)amino]benzonitrile IUPAC Name: 4-[(1,3-dimethyl-7-oxo-6-propan-2-ylpyrazolo[4,3-d]pyrimidin-5-yl)amino]benzonitrile Traditional Name: 4-[(6-isopropyl-7-keto-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-5-yl)amino]benzonitrile Formula: C17H18N6O MolecularWeight: 322.36442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N=C(N(C2=O)C(C)C)NC3=CC=C(C=C3)C#N)C

Isomeric SMILES

CC1=NN(C2=C1N=C(N(C2=O)C(C)C)NC3=CC=C(C=C3)C#N)C

InChI

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