ethyl 3-[2-[(4-cyanophenyl)-(phenylmethyl)amino]pyrimidin-4-yl]propanoate

Systemtic Name: ethyl 3-[2-[(4-cyanophenyl)-(phenylmethyl)amino]pyrimidin-4-yl]propanoate Openeye Name: ethyl 3-[2-(N-benzyl-4-cyano-anilino)pyrimidin-4-yl]propanoate CAS Name: 3-[2-(4-cyano-N-(phenylmethyl)anilino)-4-pyrimidinyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2-(N-benzyl-4-cyanoanilino)pyrimidin-4-yl]propanoate Traditional Name: 3-[2-(N-benzyl-4-cyano-anilino)pyrimidin-4-yl]propionic acid ethyl ester Formula: C23H22N4O2 MolecularWeight: 386.44638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=NC(=NC=C1)N(CC2=CC=CC=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCOC(=O)CCC1=NC(=NC=C1)N(CC2=CC=CC=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H22N4O2/c1-2-29-22(28)13-10-20-14-15-25-23(26-20)27(17-19-6-4-3-5-7-19)21-11-8-18(16-24)9-12-21/h3-9,11-12,14-15H,2,10,13,17H2,1H3