prop-2-enyl 2,4-dimethyl-6-[3-methyl-4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]carbonyl-pyrimidine-5-carboxylate

Systemtic Name: prop-2-enyl 2,4-dimethyl-6-[3-methyl-4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]carbonyl-pyrimidine-5-carboxylate Openeye Name: allyl 2,4-dimethyl-6-[3-methyl-4-[(E)-3-phenylprop-2-enoyl]piperazine-1-carbonyl]pyrimidine-5-carboxylate CAS Name: 2,4-dimethyl-6-[[3-methyl-4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]-oxomethyl]-5-pyrimidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2,4-dimethyl-6-[3-methyl-4-[(E)-3-phenylprop-2-enoyl]piperazine-1-carbonyl]pyrimidine-5-carboxylate Traditional Name: 2,4-dimethyl-6-[3-methyl-4-[(E)-3-phenylacryloyl]piperazine-1-carbonyl]pyrimidine-5-carboxylic acid allyl ester Formula: C25H28N4O4 MolecularWeight: 448.51422

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C=CC2=CC=CC=C2)C(=O)C3=C(C(=NC(=N3)C)C)C(=O)OCC=C

Isomeric SMILES

CC1CN(CCN1C(=O)/C=C/C2=CC=CC=C2)C(=O)C3=C(C(=NC(=N3)C)C)C(=O)OCC=C

InChI

InChI=1S/C25H28N4O4/c1-5-15-33-25(32)22-18(3)26-19(4)27-23(22)24(31)28-13-14-29(17(2)16-28)21(30)12-11-20-9-7-6-8-10-20/h5-12,17H,1,13-16H2,2-4H3/b12-11+