2-methylpropyl 2,4-dimethyl-6-(3-methyl-4-naphthalen-2-ylsulfonyl-piperazin-1-yl)carbonyl-pyrimidine-5-carboxylate

Systemtic Name: 2-methylpropyl 2,4-dimethyl-6-(3-methyl-4-naphthalen-2-ylsulfonyl-piperazin-1-yl)carbonyl-pyrimidine-5-carboxylate Openeye Name: isobutyl 2,4-dimethyl-6-[3-methyl-4-(2-naphthylsulfonyl)piperazine-1-carbonyl]pyrimidine-5-carboxylate CAS Name: 2,4-dimethyl-6-[[3-methyl-4-(2-naphthalenylsulfonyl)-1-piperazinyl]-oxomethyl]-5-pyrimidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2,4-dimethyl-6-(3-methyl-4-naphthalen-2-ylsulfonylpiperazine-1-carbonyl)pyrimidine-5-carboxylate Traditional Name: 2,4-dimethyl-6-[3-methyl-4-(2-naphthylsulfonyl)piperazine-1-carbonyl]pyrimidine-5-carboxylic acid isobutyl ester Formula: C27H32N4O5S MolecularWeight: 524.63178

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)C4=C(C(=NC(=N4)C)C)C(=O)OCC(C)C

Isomeric SMILES

CC1CN(CCN1S(=O)(=O)C2=CC3=CC=CC=C3C=C2)C(=O)C4=C(C(=NC(=N4)C)C)C(=O)OCC(C)C

InChI

InChI=1S/C27H32N4O5S/c1-17(2)16-36-27(33)24-19(4)28-20(5)29-25(24)26(32)30-12-13-31(18(3)15-30)37(34,35)23-11-10-21-8-6-7-9-22(21)14-23/h6-11,14,17-18H,12-13,15-16H2,1-5H3