4-(2,2-dimethylpropylamino)-5-[(3-piperidin-1-ylpropylamino)methyl]pyrimidine-2-carbonitrile

Systemtic Name: 4-(2,2-dimethylpropylamino)-5-[(3-piperidin-1-ylpropylamino)methyl]pyrimidine-2-carbonitrile Openeye Name: 4-(2,2-dimethylpropylamino)-5-[[3-(1-piperidyl)propylamino]methyl]pyrimidine-2-carbonitrile CAS Name: 4-(2,2-dimethylpropylamino)-5-[[3-(1-piperidinyl)propylamino]methyl]-2-pyrimidinecarbonitrile IUPAC Name: 4-(2,2-dimethylpropylamino)-5-[(3-piperidin-1-ylpropylamino)methyl]pyrimidine-2-carbonitrile Traditional Name: 4-(neopentylamino)-5-[(3-piperidinopropylamino)methyl]pyrimidine-2-carbonitrile Formula: C19H32N6 MolecularWeight: 344.49758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC1=NC(=NC=C1CNCCCN2CCCCC2)C#N

Isomeric SMILES

CC(C)(C)CNC1=NC(=NC=C1CNCCCN2CCCCC2)C#N

InChI

InChI=1S/C19H32N6/c1-19(2,3)15-23-18-16(14-22-17(12-20)24-18)13-21-8-7-11-25-9-5-4-6-10-25/h14,21H,4-11,13,15H2,1-3H3,(H,22,23,24)