ethyl 2-[[(Z)-2-benzamido-3-[(4,6-dimethylpyrimidin-2-yl)amino]prop-2-enoyl]amino]ethanoate

Systemtic Name: ethyl 2-[[(Z)-2-benzamido-3-[(4,6-dimethylpyrimidin-2-yl)amino]prop-2-enoyl]amino]ethanoate Openeye Name: ethyl 2-[[(Z)-2-benzamido-3-[(4,6-dimethylpyrimidin-2-yl)amino]prop-2-enoyl]amino]acetate CAS Name: 2-[[(Z)-2-benzamido-3-[(4,6-dimethyl-2-pyrimidinyl)amino]-1-oxoprop-2-enyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[(Z)-2-benzamido-3-[(4,6-dimethylpyrimidin-2-yl)amino]prop-2-enoyl]amino]acetate Traditional Name: 2-[[(Z)-2-benzamido-3-[(4,6-dimethylpyrimidin-2-yl)amino]acryloyl]amino]acetic acid ethyl ester Formula: C20H23N5O4 MolecularWeight: 397.42772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C(=CNC1=NC(=CC(=N1)C)C)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CNC(=O)/C(=C/NC1=NC(=CC(=N1)C)C)/NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H23N5O4/c1-4-29-17(26)12-21-19(28)16(25-18(27)15-8-6-5-7-9-15)11-22-20-23-13(2)10-14(3)24-20/h5-11H,4,12H2,1-3H3,(H,21,28)(H,25,27)(H,22,23,24)/b16-11-