N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)ethanamide

Systemtic Name: N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)ethanamide Openeye Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)acetamide CAS Name: N-[3-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)propyl]-2-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)acetamide IUPAC Name: N-[3-(5-amino-4-cyano-1-phenylpyrazol-3-yl)propyl]-2-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)acetamide Traditional Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(4-keto-2,6-dimethyl-1H-pyrimidin-5-yl)acetamide Formula: C21H23N7O2 MolecularWeight: 405.45302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C)CC(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C)CC(=O)NCCCC2=NN(C(=C2C#N)N)C3=CC=CC=C3

InChI

InChI=1S/C21H23N7O2/c1-13-16(21(30)26-14(2)25-13)11-19(29)24-10-6-9-18-17(12-22)20(23)28(27-18)15-7-4-3-5-8-15/h3-5,7-8H,6,9-11,23H2,1-2H3,(H,24,29)(H,25,26,30)