5-[[4-(2-diethylaminoethyl)piperazin-1-yl]methyl]-4-(2,2-dimethylpropylamino)pyrimidine-2-carbonitrile

Systemtic Name: 5-[[4-(2-diethylaminoethyl)piperazin-1-yl]methyl]-4-(2,2-dimethylpropylamino)pyrimidine-2-carbonitrile Openeye Name: 5-[[4-(2-diethylaminoethyl)piperazin-1-yl]methyl]-4-(2,2-dimethylpropylamino)pyrimidine-2-carbonitrile CAS Name: 5-[[4-(2-diethylaminoethyl)-1-piperazinyl]methyl]-4-(2,2-dimethylpropylamino)-2-pyrimidinecarbonitrile IUPAC Name: 5-[[4-(2-diethylaminoethyl)piperazin-1-yl]methyl]-4-(2,2-dimethylpropylamino)pyrimidine-2-carbonitrile Traditional Name: 5-[[4-(2-diethylaminoethyl)piperazino]methyl]-4-(neopentylamino)pyrimidine-2-carbonitrile Formula: C21H37N7 MolecularWeight: 387.56538

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1CCN(CC1)CC2=CN=C(N=C2NCC(C)(C)C)C#N

Isomeric SMILES

CCN(CC)CCN1CCN(CC1)CC2=CN=C(N=C2NCC(C)(C)C)C#N

InChI

InChI=1S/C21H37N7/c1-6-26(7-2)8-9-27-10-12-28(13-11-27)16-18-15-23-19(14-22)25-20(18)24-17-21(3,4)5/h15H,6-13,16-17H2,1-5H3,(H,23,24,25)