2-[2-methyl-3-(phenylsulfonyl)pyrrolo[2,3-b]pyridin-1-yl]ethanamine

Systemtic Name: 2-[2-methyl-3-(phenylsulfonyl)pyrrolo[2,3-b]pyridin-1-yl]ethanamine Openeye Name: 2-[3-(benzenesulfonyl)-2-methyl-pyrrolo[2,3-b]pyridin-1-yl]ethanamine CAS Name: 2-[3-(benzenesulfonyl)-2-methyl-1-pyrrolo[2,3-b]pyridinyl]ethanamine IUPAC Name: 2-[3-(benzenesulfonyl)-2-methylpyrrolo[2,3-b]pyridin-1-yl]ethanamine Traditional Name: 2-(3-besyl-2-methyl-pyrrolo[2,3-b]pyridin-1-yl)ethylamine Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CCN)N=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C2=C(N1CCN)N=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H17N3O2S/c1-12-15(22(20,21)13-6-3-2-4-7-13)14-8-5-10-18-16(14)19(12)11-9-17/h2-8,10H,9,11,17H2,1H3