(2-chloranyl-6-fluoranyl-phenyl)methyl 3-(1H-indol-3-yl)-2-(thiophen-2-ylcarbonylamino)propanoate

Systemtic Name: (2-chloranyl-6-fluoranyl-phenyl)methyl 3-(1H-indol-3-yl)-2-(thiophen-2-ylcarbonylamino)propanoate Openeye Name: (2-chloro-6-fluoro-phenyl)methyl 3-(1H-indol-3-yl)-2-(thiophene-2-carbonylamino)propanoate CAS Name: 3-(1H-indol-3-yl)-2-[[oxo(thiophen-2-yl)methyl]amino]propanoic acid (2-chloro-6-fluorophenyl)methyl ester IUPAC Name: (2-chloro-6-fluorophenyl)methyl 3-(1H-indol-3-yl)-2-(thiophene-2-carbonylamino)propanoate Traditional Name: 3-(1H-indol-3-yl)-2-(2-thenoylamino)propionic acid (2-chloro-6-fluoro-benzyl) ester Formula: C23H18ClFN2O3S MolecularWeight: 456.917023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)OCC3=C(C=CC=C3Cl)F)NC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)OCC3=C(C=CC=C3Cl)F)NC(=O)C4=CC=CS4

InChI

InChI=1S/C23H18ClFN2O3S/c24-17-6-3-7-18(25)16(17)13-30-23(29)20(27-22(28)21-9-4-10-31-21)11-14-12-26-19-8-2-1-5-15(14)19/h1-10,12,20,26H,11,13H2,(H,27,28)