ethyl 4-[1-[2-(2,6-diethylphenyl)-4-methoxy-6-methyl-pyrimidin-5-yl]butyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-[2-(2,6-diethylphenyl)-4-methoxy-6-methyl-pyrimidin-5-yl]butyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[1-[2-(2,6-diethylphenyl)-4-methoxy-6-methyl-pyrimidin-5-yl]butyl]piperazine-1-carboxylate CAS Name: 4-[1-[2-(2,6-diethylphenyl)-4-methoxy-6-methyl-5-pyrimidinyl]butyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-[2-(2,6-diethylphenyl)-4-methoxy-6-methylpyrimidin-5-yl]butyl]piperazine-1-carboxylate Traditional Name: 4-[1-[2-(2,6-diethylphenyl)-4-methoxy-6-methyl-pyrimidin-5-yl]butyl]piperazine-1-carboxylic acid ethyl ester Formula: C27H40N4O3 MolecularWeight: 468.6315

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=C(N=C(N=C1OC)C2=C(C=CC=C2CC)CC)C)N3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCCC(C1=C(N=C(N=C1OC)C2=C(C=CC=C2CC)CC)C)N3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C27H40N4O3/c1-7-12-22(30-15-17-31(18-16-30)27(32)34-10-4)23-19(5)28-25(29-26(23)33-6)24-20(8-2)13-11-14-21(24)9-3/h11,13-14,22H,7-10,12,15-18H2,1-6H3