2-[1-(1H-pyrrol-2-yl)-3-(1H-pyrrol-3-yl)-5-sulfanyl-pyrrol-2-yl]propanoic acid

Systemtic Name: 2-[1-(1H-pyrrol-2-yl)-3-(1H-pyrrol-3-yl)-5-sulfanyl-pyrrol-2-yl]propanoic acid Openeye Name: 2-[1-(1H-pyrrol-2-yl)-3-(1H-pyrrol-3-yl)-5-sulfanyl-pyrrol-2-yl]propanoic acid CAS Name: 2-[5-mercapto-1-(1H-pyrrol-2-yl)-3-(1H-pyrrol-3-yl)-2-pyrrolyl]propanoic acid IUPAC Name: 2-[1-(1H-pyrrol-2-yl)-3-(1H-pyrrol-3-yl)-5-sulfanylpyrrol-2-yl]propanoic acid Traditional Name: 2-[5-mercapto-1-(1H-pyrrol-2-yl)-3-(1H-pyrrol-3-yl)pyrrol-2-yl]propionic acid Formula: C15H15N3O2S MolecularWeight: 301.3635

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(N1C2=CC=CN2)S)C3=CNC=C3)C(=O)O

Isomeric SMILES

CC(C1=C(C=C(N1C2=CC=CN2)S)C3=CNC=C3)C(=O)O

InChI

InChI=1S/C15H15N3O2S/c1-9(15(19)20)14-11(10-4-6-16-8-10)7-13(21)18(14)12-3-2-5-17-12/h2-9,16-17,21H,1H3,(H,19,20)