ethyl 2,6-di(propan-2-yl)-4-pyridin-4-yl-1,4,5,6-tetrahydropyrimidine-5-carboxylate

Systemtic Name: ethyl 2,6-di(propan-2-yl)-4-pyridin-4-yl-1,4,5,6-tetrahydropyrimidine-5-carboxylate Openeye Name: ethyl 2,6-diisopropyl-4-(4-pyridyl)-1,4,5,6-tetrahydropyrimidine-5-carboxylate CAS Name: 2,6-di(propan-2-yl)-4-pyridin-4-yl-1,4,5,6-tetrahydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2,6-di(propan-2-yl)-4-pyridin-4-yl-1,4,5,6-tetrahydropyrimidine-5-carboxylate Traditional Name: 2,6-diisopropyl-4-(4-pyridyl)-1,4,5,6-tetrahydropyrimidine-5-carboxylic acid ethyl ester Formula: C18H27N3O2 MolecularWeight: 317.42588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(N=C(NC1C(C)C)C(C)C)C2=CC=NC=C2

Isomeric SMILES

CCOC(=O)C1C(N=C(NC1C(C)C)C(C)C)C2=CC=NC=C2

InChI

InChI=1S/C18H27N3O2/c1-6-23-18(22)14-15(11(2)3)20-17(12(4)5)21-16(14)13-7-9-19-10-8-13/h7-12,14-16H,6H2,1-5H3,(H,20,21)