3-[(6-methyl-3,5-dihydroimidazo[4,5-f]benzimidazol-2-yl)sulfanyl]propanoic acid

Systemtic Name: 3-[(6-methyl-3,5-dihydroimidazo[4,5-f]benzimidazol-2-yl)sulfanyl]propanoic acid Openeye Name: 3-[(6-methyl-3,5-dihydroimidazo[4,5-f]benzimidazol-2-yl)sulfanyl]propanoic acid CAS Name: 3-[(6-methyl-3,5-dihydroimidazo[4,5-f]benzimidazol-2-yl)thio]propanoic acid IUPAC Name: 3-[(6-methyl-3,5-dihydroimidazo[4,5-f]benzimidazol-2-yl)sulfanyl]propanoic acid Traditional Name: 3-[(6-methyl-3,5-dihydroimidazo[4,5-f]benzimidazol-2-yl)thio]propionic acid Formula: C12H12N4O2S MolecularWeight: 276.31428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC3=C(C=C2N1)NC(=N3)SCCC(=O)O

Isomeric SMILES

CC1=NC2=CC3=C(C=C2N1)NC(=N3)SCCC(=O)O

InChI

InChI=1S/C12H12N4O2S/c1-6-13-7-4-9-10(5-8(7)14-6)16-12(15-9)19-3-2-11(17)18/h4-5H,2-3H2,1H3,(H,13,14)(H,15,16)(H,17,18)