(3R)-3-[[2,6-dimethyl-5-(2-methylprop-2-enyl)pyrimidin-4-yl]amino]-3-phenyl-propanoate

Systemtic Name: (3R)-3-[[2,6-dimethyl-5-(2-methylprop-2-enyl)pyrimidin-4-yl]amino]-3-phenyl-propanoate Openeye Name: (3R)-3-[[2,6-dimethyl-5-(2-methylallyl)pyrimidin-4-yl]amino]-3-phenyl-propanoate CAS Name: (3R)-3-[[2,6-dimethyl-5-(2-methylprop-2-enyl)-4-pyrimidinyl]amino]-3-phenylpropanoate IUPAC Name: (3R)-3-[[2,6-dimethyl-5-(2-methylprop-2-enyl)pyrimidin-4-yl]amino]-3-phenylpropanoate Traditional Name: (3R)-3-[[2,6-dimethyl-5-(2-methylallyl)pyrimidin-4-yl]amino]-3-phenyl-propionate Formula: C19H22N3O2- MolecularWeight: 324.39688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)NC(CC(=O)[O-])C2=CC=CC=C2)CC(=C)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C)N[C@H](CC(=O)[O-])C2=CC=CC=C2)CC(=C)C

InChI

InChI=1S/C19H23N3O2/c1-12(2)10-16-13(3)20-14(4)21-19(16)22-17(11-18(23)24)15-8-6-5-7-9-15/h5-9,17H,1,10-11H2,2-4H3,(H,23,24)(H,20,21,22)/p-1/t17-/m1/s1