[2-[[3-(methylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-acetamido-3-thiophen-2-yl-propanoate

Systemtic Name: [2-[[3-(methylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-acetamido-3-thiophen-2-yl-propanoate Openeye Name: [2-[3-(methylcarbamoyl)anilino]-2-oxo-ethyl] 3-acetamido-3-(2-thienyl)propanoate CAS Name: 3-acetamido-3-thiophen-2-ylpropanoic acid [2-[3-(methylcarbamoyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[3-(methylcarbamoyl)anilino]-2-oxoethyl] 3-acetamido-3-thiophen-2-ylpropanoate Traditional Name: 3-acetamido-3-(2-thienyl)propionic acid [2-keto-2-[3-(methylcarbamoyl)anilino]ethyl] ester Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)OCC(=O)NC1=CC=CC(=C1)C(=O)NC)C2=CC=CS2

Isomeric SMILES

CC(=O)NC(CC(=O)OCC(=O)NC1=CC=CC(=C1)C(=O)NC)C2=CC=CS2

InChI

InChI=1S/C19H21N3O5S/c1-12(23)21-15(16-7-4-8-28-16)10-18(25)27-11-17(24)22-14-6-3-5-13(9-14)19(26)20-2/h3-9,15H,10-11H2,1-2H3,(H,20,26)(H,21,23)(H,22,24)