ethyl 6-(2,5-dimethylphenyl)-3-methyl-2-oxidanylidene-4-(pyrrolidin-1-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(2,5-dimethylphenyl)-3-methyl-2-oxidanylidene-4-(pyrrolidin-1-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(2,5-dimethylphenyl)-3-methyl-2-oxo-4-(pyrrolidin-1-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(2,5-dimethylphenyl)-3-methyl-2-oxo-4-(1-pyrrolidinylmethyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(2,5-dimethylphenyl)-3-methyl-2-oxo-4-(pyrrolidin-1-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(2,5-dimethylphenyl)-2-keto-3-methyl-4-(pyrrolidinomethyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=C(C=CC(=C2)C)C)C)CN3CCCC3

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=C(C=CC(=C2)C)C)C)CN3CCCC3

InChI

InChI=1S/C21H29N3O3/c1-5-27-20(25)18-17(13-24-10-6-7-11-24)23(4)21(26)22-19(18)16-12-14(2)8-9-15(16)3/h8-9,12,19H,5-7,10-11,13H2,1-4H3,(H,22,26)