[2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl] 3-phenyl-2-(thiophen-2-ylcarbonylamino)propanoate

Systemtic Name: [2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl] 3-phenyl-2-(thiophen-2-ylcarbonylamino)propanoate Openeye Name: [2-(5-chloro-2-thienyl)-2-oxo-ethyl] 3-phenyl-2-(thiophene-2-carbonylamino)propanoate CAS Name: 2-[[oxo(thiophen-2-yl)methyl]amino]-3-phenylpropanoic acid [2-(5-chloro-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-chlorothiophen-2-yl)-2-oxoethyl] 3-phenyl-2-(thiophene-2-carbonylamino)propanoate Traditional Name: 3-phenyl-2-(2-thenoylamino)propionic acid [2-(5-chloro-2-thienyl)-2-keto-ethyl] ester Formula: C20H16ClNO4S2 MolecularWeight: 433.92834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC(=O)C2=CC=C(S2)Cl)NC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)OCC(=O)C2=CC=C(S2)Cl)NC(=O)C3=CC=CS3

InChI

InChI=1S/C20H16ClNO4S2/c21-18-9-8-16(28-18)15(23)12-26-20(25)14(11-13-5-2-1-3-6-13)22-19(24)17-7-4-10-27-17/h1-10,14H,11-12H2,(H,22,24)