propan-2-yl 4-methyl-6-(3-methyl-4-quinolin-8-ylsulfonyl-piperazin-1-yl)carbonyl-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 4-methyl-6-(3-methyl-4-quinolin-8-ylsulfonyl-piperazin-1-yl)carbonyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: isopropyl 4-methyl-6-[3-methyl-4-(8-quinolylsulfonyl)piperazine-1-carbonyl]-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-methyl-6-[[3-methyl-4-(8-quinolinylsulfonyl)-1-piperazinyl]-oxomethyl]-2-phenyl-5-pyrimidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-methyl-6-(3-methyl-4-quinolin-8-ylsulfonylpiperazine-1-carbonyl)-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-methyl-6-[3-methyl-4-(8-quinolylsulfonyl)piperazine-1-carbonyl]-2-phenyl-pyrimidine-5-carboxylic acid isopropyl ester Formula: C30H31N5O5S MolecularWeight: 573.66264

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1S(=O)(=O)C2=CC=CC3=C2N=CC=C3)C(=O)C4=C(C(=NC(=N4)C5=CC=CC=C5)C)C(=O)OC(C)C

Isomeric SMILES

CC1CN(CCN1S(=O)(=O)C2=CC=CC3=C2N=CC=C3)C(=O)C4=C(C(=NC(=N4)C5=CC=CC=C5)C)C(=O)OC(C)C

InChI

InChI=1S/C30H31N5O5S/c1-19(2)40-30(37)25-21(4)32-28(23-10-6-5-7-11-23)33-27(25)29(36)34-16-17-35(20(3)18-34)41(38,39)24-14-8-12-22-13-9-15-31-26(22)24/h5-15,19-20H,16-18H2,1-4H3