(4-butoxyphenyl)-[4-(4-methyl-6-piperidin-1-yl-pyrimidin-2-yl)piperazin-1-yl]methanone

Systemtic Name: (4-butoxyphenyl)-[4-(4-methyl-6-piperidin-1-yl-pyrimidin-2-yl)piperazin-1-yl]methanone Openeye Name: (4-butoxyphenyl)-[4-[4-methyl-6-(1-piperidyl)pyrimidin-2-yl]piperazin-1-yl]methanone CAS Name: (4-butoxyphenyl)-[4-[4-methyl-6-(1-piperidinyl)-2-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (4-butoxyphenyl)-[4-(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)piperazin-1-yl]methanone Traditional Name: (4-butoxyphenyl)-[4-(4-methyl-6-piperidino-pyrimidin-2-yl)piperazino]methanone Formula: C25H35N5O2 MolecularWeight: 437.5777

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=CC(=N3)N4CCCCC4)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=CC(=N3)N4CCCCC4)C

InChI

InChI=1S/C25H35N5O2/c1-3-4-18-32-22-10-8-21(9-11-22)24(31)29-14-16-30(17-15-29)25-26-20(2)19-23(27-25)28-12-6-5-7-13-28/h8-11,19H,3-7,12-18H2,1-2H3