N-(2-azanylethyl)-4-(5-bromanyl-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzamide

Systemtic Name: N-(2-azanylethyl)-4-(5-bromanyl-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzamide Openeye Name: N-(2-aminoethyl)-4-(5-bromo-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzamide CAS Name: N-(2-aminoethyl)-4-(5-bromo-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzamide IUPAC Name: N-(2-aminoethyl)-4-(5-bromo-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzamide Traditional Name: N-(2-aminoethyl)-4-(5-bromo-2-phenyl-1H-pyrrolo[2,3-b]pyridin-3-yl)benzamide Formula: C22H19BrN4O MolecularWeight: 435.31646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C3=CC(=CN=C3N2)Br)C4=CC=C(C=C4)C(=O)NCCN

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C3=CC(=CN=C3N2)Br)C4=CC=C(C=C4)C(=O)NCCN

InChI

InChI=1S/C22H19BrN4O/c23-17-12-18-19(14-6-8-16(9-7-14)22(28)25-11-10-24)20(27-21(18)26-13-17)15-4-2-1-3-5-15/h1-9,12-13H,10-11,24H2,(H,25,28)(H,26,27)