2-[4-[4-(3-azanylpropylsulfamoyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]ethanamide

Systemtic Name: 2-[4-[4-(3-azanylpropylsulfamoyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]ethanamide Openeye Name: 2-[4-[4-(3-aminopropylsulfamoyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]acetamide CAS Name: 2-[4-[4-(3-aminopropylsulfamoyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]acetamide IUPAC Name: 2-[4-[4-(3-aminopropylsulfamoyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]acetamide Traditional Name: 2-[4-[4-(3-aminopropylsulfamoyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-2-yl]acetamide Formula: C18H21N5O3S MolecularWeight: 387.45604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C3C=C(NC3=NC=C2)CC(=O)N)S(=O)(=O)NCCCN

Isomeric SMILES

C1=CC(=CC=C1C2=C3C=C(NC3=NC=C2)CC(=O)N)S(=O)(=O)NCCCN

InChI

InChI=1S/C18H21N5O3S/c19-7-1-8-22-27(25,26)14-4-2-12(3-5-14)15-6-9-21-18-16(15)10-13(23-18)11-17(20)24/h2-6,9-10,22H,1,7-8,11,19H2,(H2,20,24)(H,21,23)