(3R)-N-[(2,4-dimethoxyphenyl)methyl]-1-(4,6-dimethylpyrimidin-2-yl)piperidine-3-carboxamide

Systemtic Name: (3R)-N-[(2,4-dimethoxyphenyl)methyl]-1-(4,6-dimethylpyrimidin-2-yl)piperidine-3-carboxamide Openeye Name: (3R)-N-[(2,4-dimethoxyphenyl)methyl]-1-(4,6-dimethylpyrimidin-2-yl)piperidine-3-carboxamide CAS Name: (3R)-N-[(2,4-dimethoxyphenyl)methyl]-1-(4,6-dimethyl-2-pyrimidinyl)-3-piperidinecarboxamide IUPAC Name: (3R)-N-[(2,4-dimethoxyphenyl)methyl]-1-(4,6-dimethylpyrimidin-2-yl)piperidine-3-carboxamide Traditional Name: (3R)-N-(2,4-dimethoxybenzyl)-1-(4,6-dimethylpyrimidin-2-yl)nipecotamide Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCCC(C2)C(=O)NCC3=C(C=C(C=C3)OC)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCC[C@H](C2)C(=O)NCC3=C(C=C(C=C3)OC)OC)C

InChI

InChI=1S/C21H28N4O3/c1-14-10-15(2)24-21(23-14)25-9-5-6-17(13-25)20(26)22-12-16-7-8-18(27-3)11-19(16)28-4/h7-8,10-11,17H,5-6,9,12-13H2,1-4H3,(H,22,26)/t17-/m1/s1