ethyl 4-[4-[(2-ethoxy-2-oxidanylidene-ethyl)carbamoyl]-3-methyl-piperazin-1-yl]carbonyl-2-methyl-6-propyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[4-[(2-ethoxy-2-oxidanylidene-ethyl)carbamoyl]-3-methyl-piperazin-1-yl]carbonyl-2-methyl-6-propyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[4-[(2-ethoxy-2-oxo-ethyl)carbamoyl]-3-methyl-piperazine-1-carbonyl]-2-methyl-6-propyl-pyrimidine-5-carboxylate CAS Name: 4-[[4-[[(2-ethoxy-2-oxoethyl)amino]-oxomethyl]-3-methyl-1-piperazinyl]-oxomethyl]-2-methyl-6-propyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[(2-ethoxy-2-oxoethyl)carbamoyl]-3-methylpiperazine-1-carbonyl]-2-methyl-6-propylpyrimidine-5-carboxylate Traditional Name: 4-[4-[(2-ethoxy-2-keto-ethyl)carbamoyl]-3-methyl-piperazine-1-carbonyl]-2-methyl-6-propyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H33N5O6 MolecularWeight: 463.52732

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NC(=C1C(=O)OCC)C(=O)N2CCN(C(C2)C)C(=O)NCC(=O)OCC)C

Isomeric SMILES

CCCC1=NC(=NC(=C1C(=O)OCC)C(=O)N2CCN(C(C2)C)C(=O)NCC(=O)OCC)C

InChI

InChI=1S/C22H33N5O6/c1-6-9-16-18(21(30)33-8-3)19(25-15(5)24-16)20(29)26-10-11-27(14(4)13-26)22(31)23-12-17(28)32-7-2/h14H,6-13H2,1-5H3,(H,23,31)