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

Systemtic Name: 2-[methyl-[(4-propan-2-ylphenyl)methyl]amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[(4-isopropylphenyl)methyl-methyl-amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[methyl-[(4-propan-2-ylphenyl)methyl]amino]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[methyl-[(4-propan-2-ylphenyl)methyl]amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(4-isopropylbenzyl)-methyl-amino]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C21H29N5O MolecularWeight: 367.48786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N5O/c1-17(2)19-7-5-18(6-8-19)15-24(3)16-20(27)25-11-13-26(14-12-25)21-22-9-4-10-23-21/h4-10,17H,11-16H2,1-3H3