methyl (2S)-2-[[(E)-3-(2,4-dimethoxy-6-methyl-pyrimidin-5-yl)prop-2-enoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[(E)-3-(2,4-dimethoxy-6-methyl-pyrimidin-5-yl)prop-2-enoyl]amino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[(E)-3-(2,4-dimethoxy-6-methyl-pyrimidin-5-yl)prop-2-enoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(E)-3-(2,4-dimethoxy-6-methyl-5-pyrimidinyl)-1-oxoprop-2-enyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(E)-3-(2,4-dimethoxy-6-methylpyrimidin-5-yl)prop-2-enoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[(E)-3-(2,4-dimethoxy-6-methyl-pyrimidin-5-yl)acryloyl]amino]-3-phenyl-propionic acid methyl ester Formula: C20H23N3O5 MolecularWeight: 385.41372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)OC)OC)C=CC(=O)NC(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)OC)OC)/C=C/C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C20H23N3O5/c1-13-15(18(26-2)23-20(21-13)28-4)10-11-17(24)22-16(19(25)27-3)12-14-8-6-5-7-9-14/h5-11,16H,12H2,1-4H3,(H,22,24)/b11-10+/t16-/m0/s1