[4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] 2-thiophen-2-ylethanoate

Systemtic Name: [4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] 2-thiophen-2-ylethanoate Openeye Name: [4-[(E)-2-(2-acetamido-4-pyridyl)vinyl]phenyl] 2-(2-thienyl)acetate CAS Name: 2-thiophen-2-ylacetic acid [4-[(E)-2-(2-acetamido-4-pyridinyl)ethenyl]phenyl] ester IUPAC Name: [4-[(E)-2-(2-acetamidopyridin-4-yl)ethenyl]phenyl] 2-thiophen-2-ylacetate Traditional Name: 2-(2-thienyl)acetic acid [4-[(E)-2-(2-acetamido-4-pyridyl)vinyl]phenyl] ester Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=CC(=C1)C=CC2=CC=C(C=C2)OC(=O)CC3=CC=CS3

Isomeric SMILES

CC(=O)NC1=NC=CC(=C1)/C=C/C2=CC=C(C=C2)OC(=O)CC3=CC=CS3

InChI

InChI=1S/C21H18N2O3S/c1-15(24)23-20-13-17(10-11-22-20)5-4-16-6-8-18(9-7-16)26-21(25)14-19-3-2-12-27-19/h2-13H,14H2,1H3,(H,22,23,24)/b5-4+