propan-2-yl 2,4-dimethyl-6-[3-methyl-4-(phenylsulfonyl)piperazin-1-yl]carbonyl-pyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 2,4-dimethyl-6-[3-methyl-4-(phenylsulfonyl)piperazin-1-yl]carbonyl-pyrimidine-5-carboxylate Openeye Name: isopropyl 4-[4-(benzenesulfonyl)-3-methyl-piperazine-1-carbonyl]-2,6-dimethyl-pyrimidine-5-carboxylate CAS Name: 4-[[4-(benzenesulfonyl)-3-methyl-1-piperazinyl]-oxomethyl]-2,6-dimethyl-5-pyrimidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[4-(benzenesulfonyl)-3-methylpiperazine-1-carbonyl]-2,6-dimethylpyrimidine-5-carboxylate Traditional Name: 4-(4-besyl-3-methyl-piperazine-1-carbonyl)-2,6-dimethyl-pyrimidine-5-carboxylic acid isopropyl ester Formula: C22H28N4O5S MolecularWeight: 460.54652

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CC=CC=C2)C(=O)C3=C(C(=NC(=N3)C)C)C(=O)OC(C)C

Isomeric SMILES

CC1CN(CCN1S(=O)(=O)C2=CC=CC=C2)C(=O)C3=C(C(=NC(=N3)C)C)C(=O)OC(C)C

InChI

InChI=1S/C22H28N4O5S/c1-14(2)31-22(28)19-16(4)23-17(5)24-20(19)21(27)25-11-12-26(15(3)13-25)32(29,30)18-9-7-6-8-10-18/h6-10,14-15H,11-13H2,1-5H3