4-bromanyl-N-[1-(methylamino)-3-phenyl-propan-2-yl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide

Systemtic Name: 4-bromanyl-N-[1-(methylamino)-3-phenyl-propan-2-yl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide Openeye Name: N-[1-benzyl-2-(methylamino)ethyl]-4-bromo-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide CAS Name: 4-bromo-N-[1-(methylamino)-3-phenylpropan-2-yl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2-thiophenecarboxamide IUPAC Name: 4-bromo-N-[1-(methylamino)-3-phenylpropan-2-yl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide Traditional Name: N-[1-benzyl-2-(methylamino)ethyl]-4-bromo-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide Formula: C22H21BrN4OS MolecularWeight: 469.39734

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Descriptors Computed from Structure

Canonical SMILES:

CNCC(CC1=CC=CC=C1)NC(=O)C2=CC(=C(S2)C3=C4C=CNC4=NC=C3)Br

Isomeric SMILES

CNCC(CC1=CC=CC=C1)NC(=O)C2=CC(=C(S2)C3=C4C=CNC4=NC=C3)Br

InChI

InChI=1S/C22H21BrN4OS/c1-24-13-15(11-14-5-3-2-4-6-14)27-22(28)19-12-18(23)20(29-19)16-7-9-25-21-17(16)8-10-26-21/h2-10,12,15,24H,11,13H2,1H3,(H,25,26)(H,27,28)