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

Systemtic Name: ethyl 2-methyl-4-[3-methyl-4-(phenylsulfonyl)piperazin-1-yl]carbonyl-6-propyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[4-(benzenesulfonyl)-3-methyl-piperazine-1-carbonyl]-2-methyl-6-propyl-pyrimidine-5-carboxylate CAS Name: 4-[[4-(benzenesulfonyl)-3-methyl-1-piperazinyl]-oxomethyl]-2-methyl-6-propyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(benzenesulfonyl)-3-methylpiperazine-1-carbonyl]-2-methyl-6-propylpyrimidine-5-carboxylate Traditional Name: 4-(4-besyl-3-methyl-piperazine-1-carbonyl)-2-methyl-6-propyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H30N4O5S MolecularWeight: 474.5731

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NC(=C1C(=O)OCC)C(=O)N2CCN(C(C2)C)S(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCCC1=NC(=NC(=C1C(=O)OCC)C(=O)N2CCN(C(C2)C)S(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C23H30N4O5S/c1-5-10-19-20(23(29)32-6-2)21(25-17(4)24-19)22(28)26-13-14-27(16(3)15-26)33(30,31)18-11-8-7-9-12-18/h7-9,11-12,16H,5-6,10,13-15H2,1-4H3