methyl 2-[3-[2-[[(E)-3-pyridin-3-ylprop-2-enethioyl]amino]ethyl]phenoxy]ethanoate

Systemtic Name: methyl 2-[3-[2-[[(E)-3-pyridin-3-ylprop-2-enethioyl]amino]ethyl]phenoxy]ethanoate Openeye Name: methyl 2-[3-[2-[[(E)-3-(3-pyridyl)prop-2-enethioyl]amino]ethyl]phenoxy]acetate CAS Name: 2-[3-[2-[[(E)-3-(3-pyridinyl)-1-sulfanylideneprop-2-enyl]amino]ethyl]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[3-[2-[[(E)-3-pyridin-3-ylprop-2-enethioyl]amino]ethyl]phenoxy]acetate Traditional Name: 2-[3-[2-[[(E)-3-(3-pyridyl)thioacryloyl]amino]ethyl]phenoxy]acetic acid methyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=CC(=C1)CCNC(=S)C=CC2=CN=CC=C2

Isomeric SMILES

COC(=O)COC1=CC=CC(=C1)CCNC(=S)/C=C/C2=CN=CC=C2

InChI

InChI=1S/C19H20N2O3S/c1-23-19(22)14-24-17-6-2-4-15(12-17)9-11-21-18(25)8-7-16-5-3-10-20-13-16/h2-8,10,12-13H,9,11,14H2,1H3,(H,21,25)/b8-7+