[2-[5-(2-acetamidoethyl)thiophen-2-yl]-2-oxidanylidene-ethyl] 3-benzamidobutanoate

Systemtic Name: [2-[5-(2-acetamidoethyl)thiophen-2-yl]-2-oxidanylidene-ethyl] 3-benzamidobutanoate Openeye Name: [2-[5-(2-acetamidoethyl)-2-thienyl]-2-oxo-ethyl] 3-benzamidobutanoate CAS Name: 3-benzamidobutanoic acid [2-[5-(2-acetamidoethyl)-2-thiophenyl]-2-oxoethyl] ester IUPAC Name: [2-[5-(2-acetamidoethyl)thiophen-2-yl]-2-oxoethyl] 3-benzamidobutanoate Traditional Name: 3-benzamidobutyric acid [2-[5-(2-acetamidoethyl)-2-thienyl]-2-keto-ethyl] ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC(=O)C1=CC=C(S1)CCNC(=O)C)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(CC(=O)OCC(=O)C1=CC=C(S1)CCNC(=O)C)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H24N2O5S/c1-14(23-21(27)16-6-4-3-5-7-16)12-20(26)28-13-18(25)19-9-8-17(29-19)10-11-22-15(2)24/h3-9,14H,10-13H2,1-2H3,(H,22,24)(H,23,27)