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

Systemtic Name: 4-bromanyl-N-[2-(dimethylamino)-1-phenyl-ethyl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide Openeye Name: 4-bromo-N-[2-(dimethylamino)-1-phenyl-ethyl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide CAS Name: 4-bromo-N-[2-(dimethylamino)-1-phenylethyl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2-thiophenecarboxamide IUPAC Name: 4-bromo-N-[2-(dimethylamino)-1-phenylethyl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide Traditional Name: 4-bromo-N-[2-(dimethylamino)-1-phenyl-ethyl]-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:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21BrN4OS/c1-27(2)13-18(14-6-4-3-5-7-14)26-22(28)19-12-17(23)20(29-19)15-8-10-24-21-16(15)9-11-25-21/h3-12,18H,13H2,1-2H3,(H,24,25)(H,26,28)