2-[4-(4,4-dimethylpentanoyl)piperazin-1-yl]pyrimidine-4-carbonitrile

Systemtic Name: 2-[4-(4,4-dimethylpentanoyl)piperazin-1-yl]pyrimidine-4-carbonitrile Openeye Name: 2-[4-(4,4-dimethylpentanoyl)piperazin-1-yl]pyrimidine-4-carbonitrile CAS Name: 2-[4-(4,4-dimethyl-1-oxopentyl)-1-piperazinyl]-4-pyrimidinecarbonitrile IUPAC Name: 2-[4-(4,4-dimethylpentanoyl)piperazin-1-yl]pyrimidine-4-carbonitrile Traditional Name: 2-[4-(4,4-dimethylpentanoyl)piperazino]pyrimidine-4-carbonitrile Formula: C16H23N5O MolecularWeight: 301.38672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCC(=O)N1CCN(CC1)C2=NC=CC(=N2)C#N

Isomeric SMILES

CC(C)(C)CCC(=O)N1CCN(CC1)C2=NC=CC(=N2)C#N

InChI

InChI=1S/C16H23N5O/c1-16(2,3)6-4-14(22)20-8-10-21(11-9-20)15-18-7-5-13(12-17)19-15/h5,7H,4,6,8-11H2,1-3H3