[2-(butylamino)-2-oxidanylidene-ethyl] 3-acetamido-3-thiophen-2-yl-propanoate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 3-acetamido-3-thiophen-2-yl-propanoate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 3-acetamido-3-(2-thienyl)propanoate CAS Name: 3-acetamido-3-thiophen-2-ylpropanoic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 3-acetamido-3-thiophen-2-ylpropanoate Traditional Name: 3-acetamido-3-(2-thienyl)propionic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C15H22N2O4S MolecularWeight: 326.41118

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)CC(C1=CC=CS1)NC(=O)C

Isomeric SMILES

CCCCNC(=O)COC(=O)CC(C1=CC=CS1)NC(=O)C

InChI

InChI=1S/C15H22N2O4S/c1-3-4-7-16-14(19)10-21-15(20)9-12(17-11(2)18)13-6-5-8-22-13/h5-6,8,12H,3-4,7,9-10H2,1-2H3,(H,16,19)(H,17,18)