prop-2-enyl 4-methyl-6-(3-methyl-4-pentanoyl-piperazin-1-yl)carbonyl-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: prop-2-enyl 4-methyl-6-(3-methyl-4-pentanoyl-piperazin-1-yl)carbonyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: allyl 4-methyl-6-(3-methyl-4-pentanoyl-piperazine-1-carbonyl)-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-methyl-6-[[3-methyl-4-(1-oxopentyl)-1-piperazinyl]-oxomethyl]-2-phenyl-5-pyrimidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-methyl-6-(3-methyl-4-pentanoylpiperazine-1-carbonyl)-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-methyl-6-(3-methyl-4-valeryl-piperazine-1-carbonyl)-2-phenyl-pyrimidine-5-carboxylic acid allyl ester Formula: C26H32N4O4 MolecularWeight: 464.55668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1C)C(=O)C2=C(C(=NC(=N2)C3=CC=CC=C3)C)C(=O)OCC=C

Isomeric SMILES

CCCCC(=O)N1CCN(CC1C)C(=O)C2=C(C(=NC(=N2)C3=CC=CC=C3)C)C(=O)OCC=C

InChI

InChI=1S/C26H32N4O4/c1-5-7-13-21(31)30-15-14-29(17-18(30)3)25(32)23-22(26(33)34-16-6-2)19(4)27-24(28-23)20-11-9-8-10-12-20/h6,8-12,18H,2,5,7,13-17H2,1,3-4H3