[2-[[2,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-(1H-indol-3-yl)-2-(thiophen-2-ylcarbonylamino)propanoate

Systemtic Name: [2-[[2,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl] 3-(1H-indol-3-yl)-2-(thiophen-2-ylcarbonylamino)propanoate Openeye Name: [2-(2,5-dichloroanilino)-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-(2,5-dichloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dichloroanilino)-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-(2,5-dichloroanilino)-2-keto-ethyl] ester Formula: C24H19Cl2N3O4S MolecularWeight: 516.39636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)OCC(=O)NC3=C(C=CC(=C3)Cl)Cl)NC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)OCC(=O)NC3=C(C=CC(=C3)Cl)Cl)NC(=O)C4=CC=CS4

InChI

InChI=1S/C24H19Cl2N3O4S/c25-15-7-8-17(26)19(11-15)28-22(30)13-33-24(32)20(29-23(31)21-6-3-9-34-21)10-14-12-27-18-5-2-1-4-16(14)18/h1-9,11-12,20,27H,10,13H2,(H,28,30)(H,29,31)