4-methyl-5-[2-[4-(phenylmethyl)piperazin-1-yl]pyrimidin-4-yl]-2-piperidin-1-yl-pyrimidine

Systemtic Name: 4-methyl-5-[2-[4-(phenylmethyl)piperazin-1-yl]pyrimidin-4-yl]-2-piperidin-1-yl-pyrimidine Openeye Name: 5-[2-(4-benzylpiperazin-1-yl)pyrimidin-4-yl]-4-methyl-2-(1-piperidyl)pyrimidine CAS Name: 4-methyl-5-[2-[4-(phenylmethyl)-1-piperazinyl]-4-pyrimidinyl]-2-(1-piperidinyl)pyrimidine IUPAC Name: 5-[2-(4-benzylpiperazin-1-yl)pyrimidin-4-yl]-4-methyl-2-piperidin-1-ylpyrimidine Traditional Name: 5-[2-(4-benzylpiperazino)pyrimidin-4-yl]-4-methyl-2-piperidino-pyrimidine Formula: C25H31N7 MolecularWeight: 429.56054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C2=NC(=NC=C2)N3CCN(CC3)CC4=CC=CC=C4)N5CCCCC5

Isomeric SMILES

CC1=NC(=NC=C1C2=NC(=NC=C2)N3CCN(CC3)CC4=CC=CC=C4)N5CCCCC5

InChI

InChI=1S/C25H31N7/c1-20-22(18-27-25(28-20)31-12-6-3-7-13-31)23-10-11-26-24(29-23)32-16-14-30(15-17-32)19-21-8-4-2-5-9-21/h2,4-5,8-11,18H,3,6-7,12-17,19H2,1H3