3-(3-ethyl-2-methyl-pyrrolo[3,2-f]benzimidazol-5-yl)propane-1-sulfonic acid

Systemtic Name: 3-(3-ethyl-2-methyl-pyrrolo[3,2-f]benzimidazol-5-yl)propane-1-sulfonic acid Openeye Name: 3-(3-ethyl-2-methyl-pyrrolo[3,2-f]benzimidazol-5-yl)propane-1-sulfonic acid CAS Name: 3-(3-ethyl-2-methyl-5-pyrrolo[3,2-f]benzimidazolyl)-1-propanesulfonic acid IUPAC Name: 3-(3-ethyl-2-methylpyrrolo[3,2-f]benzimidazol-5-yl)propane-1-sulfonic acid Traditional Name: 3-(3-ethyl-2-methyl-pyrrolo[3,2-f]benzimidazol-5-yl)propane-1-sulfonic acid Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1C=C3C(=C2)C=CN3CCCS(=O)(=O)O)C

Isomeric SMILES

CCN1C(=NC2=C1C=C3C(=C2)C=CN3CCCS(=O)(=O)O)C

InChI

InChI=1S/C15H19N3O3S/c1-3-18-11(2)16-13-9-12-5-7-17(14(12)10-15(13)18)6-4-8-22(19,20)21/h5,7,9-10H,3-4,6,8H2,1-2H3,(H,19,20,21)