(phenylmethyl) 2-(3,5-dimethyl-4-oxidanylidene-1,3,5-triazinan-1-yl)-6-methyl-4-propyl-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: (phenylmethyl) 2-(3,5-dimethyl-4-oxidanylidene-1,3,5-triazinan-1-yl)-6-methyl-4-propyl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: benzyl 2-(3,5-dimethyl-4-oxo-1,3,5-triazinan-1-yl)-6-methyl-4-propyl-1,4-dihydropyrimidine-5-carboxylate CAS Name: 2-(3,5-dimethyl-4-oxo-1,3,5-triazinan-1-yl)-6-methyl-4-propyl-1,4-dihydropyrimidine-5-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(3,5-dimethyl-4-oxo-1,3,5-triazinan-1-yl)-6-methyl-4-propyl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 2-(4-keto-3,5-dimethyl-1,3,5-triazinan-1-yl)-6-methyl-4-propyl-1,4-dihydropyrimidine-5-carboxylic acid benzyl ester Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=C(NC(=N1)N2CN(C(=O)N(C2)C)C)C)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CCCC1C(=C(NC(=N1)N2CN(C(=O)N(C2)C)C)C)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H29N5O3/c1-5-9-17-18(19(27)29-12-16-10-7-6-8-11-16)15(2)22-20(23-17)26-13-24(3)21(28)25(4)14-26/h6-8,10-11,17H,5,9,12-14H2,1-4H3,(H,22,23)