ethyl 3-[furan-2-ylmethyl(pyridin-3-ylmethylcarbamothioyl)amino]propanoate

Systemtic Name: ethyl 3-[furan-2-ylmethyl(pyridin-3-ylmethylcarbamothioyl)amino]propanoate Openeye Name: ethyl 3-[2-furylmethyl(3-pyridylmethylcarbamothioyl)amino]propanoate CAS Name: 3-[2-furanylmethyl-[(3-pyridinylmethylamino)-sulfanylidenemethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[furan-2-ylmethyl(pyridin-3-ylmethylcarbamothioyl)amino]propanoate Traditional Name: 3-[2-furfuryl(3-pyridylmethylthiocarbamoyl)amino]propionic acid ethyl ester Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CO1)C(=S)NCC2=CN=CC=C2

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CO1)C(=S)NCC2=CN=CC=C2

InChI

InChI=1S/C17H21N3O3S/c1-2-22-16(21)7-9-20(13-15-6-4-10-23-15)17(24)19-12-14-5-3-8-18-11-14/h3-6,8,10-11H,2,7,9,12-13H2,1H3,(H,19,24)