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

Systemtic Name: ethyl 3-ethyl-6-(4-methoxyphenyl)-2-oxidanylidene-4-(pyrrolidin-1-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-ethyl-6-(4-methoxyphenyl)-2-oxo-4-(pyrrolidin-1-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-ethyl-6-(4-methoxyphenyl)-2-oxo-4-(1-pyrrolidinylmethyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-ethyl-6-(4-methoxyphenyl)-2-oxo-4-(pyrrolidin-1-ylmethyl)-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-ethyl-2-keto-6-(4-methoxyphenyl)-4-(pyrrolidinomethyl)-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(NC1=O)C2=CC=C(C=C2)OC)C(=O)OCC)CN3CCCC3

Isomeric SMILES

CCN1C(=C(C(NC1=O)C2=CC=C(C=C2)OC)C(=O)OCC)CN3CCCC3

InChI

InChI=1S/C21H29N3O4/c1-4-24-17(14-23-12-6-7-13-23)18(20(25)28-5-2)19(22-21(24)26)15-8-10-16(27-3)11-9-15/h8-11,19H,4-7,12-14H2,1-3H3,(H,22,26)