2-[[1-(4-butan-2-ylphenyl)-2-methyl-propyl]amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[[1-(4-butan-2-ylphenyl)-2-methyl-propyl]amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[[2-methyl-1-(4-sec-butylphenyl)propyl]amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[[1-(4-butan-2-ylphenyl)-2-methylpropyl]amino]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[[1-(4-butan-2-ylphenyl)-2-methylpropyl]amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[[2-methyl-1-(4-sec-butylphenyl)propyl]amino]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C24H35N5O MolecularWeight: 409.5676

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(C(C)C)NCC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(C(C)C)NCC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C24H35N5O/c1-5-19(4)20-7-9-21(10-8-20)23(18(2)3)27-17-22(30)28-13-15-29(16-14-28)24-25-11-6-12-26-24/h6-12,18-19,23,27H,5,13-17H2,1-4H3