2-[3-(3-fluorophenyl)sulfonylpyrrolo[2,3-b]pyridin-1-yl]-N-methyl-ethanamine

Systemtic Name: 2-[3-(3-fluorophenyl)sulfonylpyrrolo[2,3-b]pyridin-1-yl]-N-methyl-ethanamine Openeye Name: 2-[3-(3-fluorophenyl)sulfonylpyrrolo[2,3-b]pyridin-1-yl]-N-methyl-ethanamine CAS Name: 2-[3-(3-fluorophenyl)sulfonyl-1-pyrrolo[2,3-b]pyridinyl]-N-methylethanamine IUPAC Name: 2-[3-(3-fluorophenyl)sulfonylpyrrolo[2,3-b]pyridin-1-yl]-N-methylethanamine Traditional Name: 2-[3-(3-fluorophenyl)sulfonylpyrrolo[2,3-b]pyridin-1-yl]ethyl-methyl-amine Formula: C16H16FN3O2S MolecularWeight: 333.380543

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Descriptors Computed from Structure

Canonical SMILES:

CNCCN1C=C(C2=C1N=CC=C2)S(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

CNCCN1C=C(C2=C1N=CC=C2)S(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C16H16FN3O2S/c1-18-8-9-20-11-15(14-6-3-7-19-16(14)20)23(21,22)13-5-2-4-12(17)10-13/h2-7,10-11,18H,8-9H2,1H3