ethyl 4-[1-methyl-3-[(4-methylsulfonylphenyl)methyl]-2,6-bis(oxidanylidene)pyrimidin-4-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-methyl-3-[(4-methylsulfonylphenyl)methyl]-2,6-bis(oxidanylidene)pyrimidin-4-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[1-methyl-3-[(4-methylsulfonylphenyl)methyl]-2,6-dioxo-pyrimidin-4-yl]piperazine-1-carboxylate CAS Name: 4-[1-methyl-3-[(4-methylsulfonylphenyl)methyl]-2,6-dioxo-4-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-methyl-3-[(4-methylsulfonylphenyl)methyl]-2,6-dioxopyrimidin-4-yl]piperazine-1-carboxylate Traditional Name: 4-[2,6-diketo-3-(4-mesylbenzyl)-1-methyl-pyrimidin-4-yl]piperazine-1-carboxylic acid ethyl ester Formula: C20H26N4O6S MolecularWeight: 450.50864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=CC(=O)N(C(=O)N2CC3=CC=C(C=C3)S(=O)(=O)C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=CC(=O)N(C(=O)N2CC3=CC=C(C=C3)S(=O)(=O)C)C

InChI

InChI=1S/C20H26N4O6S/c1-4-30-20(27)23-11-9-22(10-12-23)17-13-18(25)21(2)19(26)24(17)14-15-5-7-16(8-6-15)31(3,28)29/h5-8,13H,4,9-12,14H2,1-3H3