(2-chloranyl-4-fluoranyl-phenyl)methyl 3-(1H-indol-3-yl)-2-(thiophen-2-ylcarbonylamino)propanoate

Systemtic Name: (2-chloranyl-4-fluoranyl-phenyl)methyl 3-(1H-indol-3-yl)-2-(thiophen-2-ylcarbonylamino)propanoate Openeye Name: (2-chloro-4-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-4-fluorophenyl)methyl ester IUPAC Name: (2-chloro-4-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-4-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=C(C=C3)F)Cl)NC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)OCC3=C(C=C(C=C3)F)Cl)NC(=O)C4=CC=CS4

InChI

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