[2-(2-bromophenyl)-2-oxidanylidene-ethyl] 3-(1H-indol-3-yl)-2-(thiophen-2-ylcarbonylamino)propanoate

Systemtic Name: [2-(2-bromophenyl)-2-oxidanylidene-ethyl] 3-(1H-indol-3-yl)-2-(thiophen-2-ylcarbonylamino)propanoate Openeye Name: [2-(2-bromophenyl)-2-oxo-ethyl] 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-(2-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2-bromophenyl)-2-oxoethyl] 3-(1H-indol-3-yl)-2-(thiophene-2-carbonylamino)propanoate Traditional Name: 3-(1H-indol-3-yl)-2-(2-thenoylamino)propionic acid [2-(2-bromophenyl)-2-keto-ethyl] ester Formula: C24H19BrN2O4S MolecularWeight: 511.38766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)OCC(=O)C3=CC=CC=C3Br)NC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)OCC(=O)C3=CC=CC=C3Br)NC(=O)C4=CC=CS4

InChI

InChI=1S/C24H19BrN2O4S/c25-18-8-3-1-7-17(18)21(28)14-31-24(30)20(27-23(29)22-10-5-11-32-22)12-15-13-26-19-9-4-2-6-16(15)19/h1-11,13,20,26H,12,14H2,(H,27,29)