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

Systemtic Name: 4-bromanyl-N-[1-(ethylamino)-3-phenyl-propan-2-yl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide Openeye Name: N-[1-benzyl-2-(ethylamino)ethyl]-4-bromo-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide CAS Name: 4-bromo-N-[1-(ethylamino)-3-phenylpropan-2-yl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)-2-thiophenecarboxamide IUPAC Name: 4-bromo-N-[1-(ethylamino)-3-phenylpropan-2-yl]-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide Traditional Name: N-[1-benzyl-2-(ethylamino)ethyl]-4-bromo-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide Formula: C23H23BrN4OS MolecularWeight: 483.42392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23BrN4OS/c1-2-25-14-16(12-15-6-4-3-5-7-15)28-23(29)20-13-19(24)21(30-20)17-8-10-26-22-18(17)9-11-27-22/h3-11,13,16,25H,2,12,14H2,1H3,(H,26,27)(H,28,29)