3-(2-azanylethyl)-5-[(2-oxidanylidene-1,3-thiazolidin-4-yl)methyl]-1H-indole-2-carboxylic acid

Systemtic Name: 3-(2-azanylethyl)-5-[(2-oxidanylidene-1,3-thiazolidin-4-yl)methyl]-1H-indole-2-carboxylic acid Openeye Name: 3-(2-aminoethyl)-5-[(2-oxothiazolidin-4-yl)methyl]-1H-indole-2-carboxylic acid CAS Name: 3-(2-aminoethyl)-5-[(2-oxo-4-thiazolidinyl)methyl]-1H-indole-2-carboxylic acid IUPAC Name: 3-(2-aminoethyl)-5-[(2-oxo-1,3-thiazolidin-4-yl)methyl]-1H-indole-2-carboxylic acid Traditional Name: 3-(2-aminoethyl)-5-[(2-ketothiazolidin-4-yl)methyl]-1H-indole-2-carboxylic acid Formula: C15H17N3O3S MolecularWeight: 319.37878

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=O)S1)CC2=CC3=C(C=C2)NC(=C3CCN)C(=O)O

Isomeric SMILES

C1C(NC(=O)S1)CC2=CC3=C(C=C2)NC(=C3CCN)C(=O)O

InChI

InChI=1S/C15H17N3O3S/c16-4-3-10-11-6-8(5-9-7-22-15(21)17-9)1-2-12(11)18-13(10)14(19)20/h1-2,6,9,18H,3-5,7,16H2,(H,17,21)(H,19,20)