propan-2-yl 4-methyl-6-(3-methyl-4-methylsulfonyl-piperazin-1-yl)carbonyl-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 4-methyl-6-(3-methyl-4-methylsulfonyl-piperazin-1-yl)carbonyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: isopropyl 4-methyl-6-(3-methyl-4-methylsulfonyl-piperazine-1-carbonyl)-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-methyl-6-[(3-methyl-4-methylsulfonyl-1-piperazinyl)-oxomethyl]-2-phenyl-5-pyrimidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-methyl-6-(3-methyl-4-methylsulfonylpiperazine-1-carbonyl)-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-(4-mesyl-3-methyl-piperazine-1-carbonyl)-6-methyl-2-phenyl-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)C)C(=O)C2=C(C(=NC(=N2)C3=CC=CC=C3)C)C(=O)OC(C)C

Isomeric SMILES

CC1CN(CCN1S(=O)(=O)C)C(=O)C2=C(C(=NC(=N2)C3=CC=CC=C3)C)C(=O)OC(C)C

InChI

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