methyl (2S)-2-benzamido-3-[2-(phenylmethyl)pyrimidin-4-yl]propanoate

Systemtic Name: methyl (2S)-2-benzamido-3-[2-(phenylmethyl)pyrimidin-4-yl]propanoate Openeye Name: methyl (2S)-2-benzamido-3-(2-benzylpyrimidin-4-yl)propanoate CAS Name: (2S)-2-benzamido-3-[2-(phenylmethyl)-4-pyrimidinyl]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-benzamido-3-(2-benzylpyrimidin-4-yl)propanoate Traditional Name: (2S)-2-benzamido-3-(2-benzylpyrimidin-4-yl)propionic acid methyl ester Formula: C22H21N3O3 MolecularWeight: 375.42044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=NC(=NC=C1)CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@H](CC1=NC(=NC=C1)CC2=CC=CC=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H21N3O3/c1-28-22(27)19(25-21(26)17-10-6-3-7-11-17)15-18-12-13-23-20(24-18)14-16-8-4-2-5-9-16/h2-13,19H,14-15H2,1H3,(H,25,26)/t19-/m0/s1