ethyl 2-ethoxy-3-[4-[1-(5-pyrimidin-2-ylthiophen-2-yl)ethoxy]phenyl]propanoate

Systemtic Name: ethyl 2-ethoxy-3-[4-[1-(5-pyrimidin-2-ylthiophen-2-yl)ethoxy]phenyl]propanoate Openeye Name: ethyl 2-ethoxy-3-[4-[1-(5-pyrimidin-2-yl-2-thienyl)ethoxy]phenyl]propanoate CAS Name: 2-ethoxy-3-[4-[1-[5-(2-pyrimidinyl)-2-thiophenyl]ethoxy]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-ethoxy-3-[4-[1-(5-pyrimidin-2-ylthiophen-2-yl)ethoxy]phenyl]propanoate Traditional Name: 2-ethoxy-3-[4-[1-[5-(2-pyrimidyl)-2-thienyl]ethoxy]phenyl]propionic acid ethyl ester Formula: C23H26N2O4S MolecularWeight: 426.52854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OC(C)C2=CC=C(S2)C3=NC=CC=N3)C(=O)OCC

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OC(C)C2=CC=C(S2)C3=NC=CC=N3)C(=O)OCC

InChI

InChI=1S/C23H26N2O4S/c1-4-27-19(23(26)28-5-2)15-17-7-9-18(10-8-17)29-16(3)20-11-12-21(30-20)22-24-13-6-14-25-22/h6-14,16,19H,4-5,15H2,1-3H3