2-[1-(4-tert-butylphenyl)sulfonylpyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-ethanamine

Systemtic Name: 2-[1-(4-tert-butylphenyl)sulfonylpyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-ethanamine Openeye Name: 2-[1-(4-tert-butylphenyl)sulfonylpyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethyl-ethanamine CAS Name: 2-[1-(4-tert-butylphenyl)sulfonyl-3-pyrrolo[2,3-b]pyridinyl]-N,N-dimethylethanamine IUPAC Name: 2-[1-(4-tert-butylphenyl)sulfonylpyrrolo[2,3-b]pyridin-3-yl]-N,N-dimethylethanamine Traditional Name: 2-[1-(4-tert-butylphenyl)sulfonylpyrrolo[2,3-b]pyridin-3-yl]ethyl-dimethyl-amine Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O2S/c1-21(2,3)17-8-10-18(11-9-17)27(25,26)24-15-16(12-14-23(4)5)19-7-6-13-22-20(19)24/h6-11,13,15H,12,14H2,1-5H3