2-[3-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridin-1-yl]ethanamine

Systemtic Name: 2-[3-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridin-1-yl]ethanamine Openeye Name: 2-[3-(p-tolylsulfonyl)pyrrolo[2,3-b]pyridin-1-yl]ethanamine CAS Name: 2-[3-(4-methylphenyl)sulfonyl-1-pyrrolo[2,3-b]pyridinyl]ethanamine IUPAC Name: 2-[3-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyridin-1-yl]ethanamine Traditional Name: 2-(3-tosylpyrrolo[2,3-b]pyridin-1-yl)ethylamine Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=C2C=CC=N3)CCN

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=C2C=CC=N3)CCN

InChI

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