3-[(5-bromanylthiophen-3-yl)methylamino]-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-[(5-bromanylthiophen-3-yl)methylamino]-3-thiophen-2-yl-propanoic acid Openeye Name: 3-[(5-bromo-3-thienyl)methylamino]-3-(2-thienyl)propanoic acid CAS Name: 3-[(5-bromo-3-thiophenyl)methylamino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-[(5-bromothiophen-3-yl)methylamino]-3-thiophen-2-ylpropanoic acid Traditional Name: 3-[(5-bromo-3-thienyl)methylamino]-3-(2-thienyl)propionic acid Formula: C12H12BrNO2S2 MolecularWeight: 346.26318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(CC(=O)O)NCC2=CSC(=C2)Br

Isomeric SMILES

C1=CSC(=C1)C(CC(=O)O)NCC2=CSC(=C2)Br

InChI

InChI=1S/C12H12BrNO2S2/c13-11-4-8(7-18-11)6-14-9(5-12(15)16)10-2-1-3-17-10/h1-4,7,9,14H,5-6H2,(H,15,16)