ethyl (4R)-6-[[(E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoyl]oxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4R)-6-[[(E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoyl]oxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4R)-6-[[(E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoyl]oxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-[[(E)-2-cyano-3-(4-dimethylaminophenyl)-1-oxoprop-2-enoxy]methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-6-[[(E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoyl]oxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-6-[[(E)-2-cyano-3-(4-dimethylaminophenyl)acryloyl]oxymethyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)C(=CC2=CC=C(C=C2)N(C)C)C#N

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@@H]1C)COC(=O)/C(=C/C2=CC=C(C=C2)N(C)C)/C#N

InChI

InChI=1S/C21H24N4O5/c1-5-29-20(27)18-13(2)23-21(28)24-17(18)12-30-19(26)15(11-22)10-14-6-8-16(9-7-14)25(3)4/h6-10,13H,5,12H2,1-4H3,(H2,23,24,28)/b15-10+/t13-/m1/s1