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

Systemtic Name: [1-(naphthalen-2-ylamino)-1-oxidanylidene-propan-2-yl] 3-acetamido-3-thiophen-2-yl-propanoate Openeye Name: [1-methyl-2-(2-naphthylamino)-2-oxo-ethyl] 3-acetamido-3-(2-thienyl)propanoate CAS Name: 3-acetamido-3-thiophen-2-ylpropanoic acid [1-(2-naphthalenylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(naphthalen-2-ylamino)-1-oxopropan-2-yl] 3-acetamido-3-thiophen-2-ylpropanoate Traditional Name: 3-acetamido-3-(2-thienyl)propionic acid [2-keto-1-methyl-2-(2-naphthylamino)ethyl] ester Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)OC(=O)CC(C3=CC=CS3)NC(=O)C

Isomeric SMILES

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)OC(=O)CC(C3=CC=CS3)NC(=O)C

InChI

InChI=1S/C22H22N2O4S/c1-14(22(27)24-18-10-9-16-6-3-4-7-17(16)12-18)28-21(26)13-19(23-15(2)25)20-8-5-11-29-20/h3-12,14,19H,13H2,1-2H3,(H,23,25)(H,24,27)