ethyl 3-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]carbonylpiperidine-1-carboxylate

Systemtic Name: ethyl 3-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]carbonylpiperidine-1-carboxylate Openeye Name: ethyl 3-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazine-1-carbonyl]piperidine-1-carboxylate CAS Name: 3-[[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazine-1-carbonyl]piperidine-1-carboxylate Traditional Name: 3-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazine-1-carbonyl]piperidine-1-carboxylic acid ethyl ester Formula: C21H33N5O3 MolecularWeight: 403.51842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCC(C1)C(=O)N2CCN(CC2)C3=NC(=NC(=C3)C)C(C)C

Isomeric SMILES

CCOC(=O)N1CCCC(C1)C(=O)N2CCN(CC2)C3=NC(=NC(=C3)C)C(C)C

InChI

InChI=1S/C21H33N5O3/c1-5-29-21(28)26-8-6-7-17(14-26)20(27)25-11-9-24(10-12-25)18-13-16(4)22-19(23-18)15(2)3/h13,15,17H,5-12,14H2,1-4H3