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

Systemtic Name: 2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrolo[2,3-b]pyridin-3-yl]ethanamine Openeye Name: 2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrolo[2,3-b]pyridin-3-yl]ethanamine CAS Name: 2-[1-(3,4-dimethoxyphenyl)sulfonyl-3-pyrrolo[2,3-b]pyridinyl]ethanamine IUPAC Name: 2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrolo[2,3-b]pyridin-3-yl]ethanamine Traditional Name: 2-[1-(3,4-dimethoxyphenyl)sulfonylpyrrolo[2,3-b]pyridin-3-yl]ethylamine Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2C=C(C3=C2N=CC=C3)CCN)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2C=C(C3=C2N=CC=C3)CCN)OC

InChI

InChI=1S/C17H19N3O4S/c1-23-15-6-5-13(10-16(15)24-2)25(21,22)20-11-12(7-8-18)14-4-3-9-19-17(14)20/h3-6,9-11H,7-8,18H2,1-2H3