[2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl] 3-acetamido-3-thiophen-2-yl-propanoate

Systemtic Name: [2-(naphthalen-1-ylamino)-2-oxidanylidene-ethyl] 3-acetamido-3-thiophen-2-yl-propanoate Openeye Name: [2-(1-naphthylamino)-2-oxo-ethyl] 3-acetamido-3-(2-thienyl)propanoate CAS Name: 3-acetamido-3-thiophen-2-ylpropanoic acid [2-(1-naphthalenylamino)-2-oxoethyl] ester IUPAC Name: [2-(naphthalen-1-ylamino)-2-oxoethyl] 3-acetamido-3-thiophen-2-ylpropanoate Traditional Name: 3-acetamido-3-(2-thienyl)propionic acid [2-keto-2-(1-naphthylamino)ethyl] ester Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)OCC(=O)NC1=CC=CC2=CC=CC=C21)C3=CC=CS3

Isomeric SMILES

CC(=O)NC(CC(=O)OCC(=O)NC1=CC=CC2=CC=CC=C21)C3=CC=CS3

InChI

InChI=1S/C21H20N2O4S/c1-14(24)22-18(19-10-5-11-28-19)12-21(26)27-13-20(25)23-17-9-4-7-15-6-2-3-8-16(15)17/h2-11,18H,12-13H2,1H3,(H,22,24)(H,23,25)