2-[(5-bromanylthiophen-2-yl)sulfonylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[(5-bromanylthiophen-2-yl)sulfonylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid Openeye Name: 2-[(5-bromo-2-thienyl)sulfonylamino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid CAS Name: 2-[(5-bromo-2-thiophenyl)sulfonylamino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid IUPAC Name: 2-[(5-bromothiophen-2-yl)sulfonylamino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid Traditional Name: 2-[(5-bromo-2-thienyl)sulfonylamino]-3-(5-hydroxy-1H-indol-3-yl)propionic acid Formula: C15H13BrN2O5S2 MolecularWeight: 445.30812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)C(=CN2)CC(C(=O)O)NS(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1=CC2=C(C=C1O)C(=CN2)CC(C(=O)O)NS(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C15H13BrN2O5S2/c16-13-3-4-14(24-13)25(22,23)18-12(15(20)21)5-8-7-17-11-2-1-9(19)6-10(8)11/h1-4,6-7,12,17-19H,5H2,(H,20,21)