4-(1-azanylethyl)-N1-(1H-pyrrolo[2,3-b]pyridin-4-yl)benzene-1,3-dicarboxamide

Systemtic Name: 4-(1-azanylethyl)-N1-(1H-pyrrolo[2,3-b]pyridin-4-yl)benzene-1,3-dicarboxamide Openeye Name: 4-(1-aminoethyl)-N1-(1H-pyrrolo[2,3-b]pyridin-4-yl)benzene-1,3-dicarboxamide CAS Name: 4-(1-aminoethyl)-N1-(1H-pyrrolo[2,3-b]pyridin-4-yl)benzene-1,3-dicarboxamide IUPAC Name: 4-(1-aminoethyl)-1-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)benzene-1,3-dicarboxamide Traditional Name: 4-(1-aminoethyl)-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)isophthalamide Formula: C17H17N5O2 MolecularWeight: 323.34918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)C(=O)NC2=C3C=CNC3=NC=C2)C(=O)N)N

Isomeric SMILES

CC(C1=C(C=C(C=C1)C(=O)NC2=C3C=CNC3=NC=C2)C(=O)N)N

InChI

InChI=1S/C17H17N5O2/c1-9(18)11-3-2-10(8-13(11)15(19)23)17(24)22-14-5-7-21-16-12(14)4-6-20-16/h2-9H,18H2,1H3,(H2,19,23)(H2,20,21,22,24)