tert-butyl 2-[4-(4-sulfamoylphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]ethanoate

Systemtic Name: tert-butyl 2-[4-(4-sulfamoylphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]ethanoate Openeye Name: tert-butyl 2-[4-(4-sulfamoylphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]acetate CAS Name: 2-[4-(4-sulfamoylphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-(4-sulfamoylphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]acetate Traditional Name: 2-[4-(4-sulfamoylphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]acetic acid tert-butyl ester Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC1=CC2=C(C=CN=C2N1)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)CC1=CC2=C(C=CN=C2N1)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C19H21N3O4S/c1-19(2,3)26-17(23)11-13-10-16-15(8-9-21-18(16)22-13)12-4-6-14(7-5-12)27(20,24)25/h4-10H,11H2,1-3H3,(H,21,22)(H2,20,24,25)