3-[6-bromanyl-1-(3-imidazol-1-ylpropyl)indol-3-yl]-4-pyrrolo[3,2-b]pyridin-1-yl-pyrrole-2,5-dione

Systemtic Name: 3-[6-bromanyl-1-(3-imidazol-1-ylpropyl)indol-3-yl]-4-pyrrolo[3,2-b]pyridin-1-yl-pyrrole-2,5-dione Openeye Name: 3-[6-bromo-1-(3-imidazol-1-ylpropyl)indol-3-yl]-4-pyrrolo[3,2-b]pyridin-1-yl-pyrrole-2,5-dione CAS Name: 3-[6-bromo-1-[3-(1-imidazolyl)propyl]-3-indolyl]-4-(1-pyrrolo[3,2-b]pyridinyl)pyrrole-2,5-dione IUPAC Name: 3-[6-bromo-1-(3-imidazol-1-ylpropyl)indol-3-yl]-4-pyrrolo[3,2-b]pyridin-1-ylpyrrole-2,5-dione Traditional Name: 3-[6-bromo-1-(3-imidazol-1-ylpropyl)indol-3-yl]-4-pyrrolo[3,2-b]pyridin-1-yl-3-pyrroline-2,5-quinone Formula: C25H19BrN6O2 MolecularWeight: 515.36136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN2C3=C(C(=O)NC3=O)C4=CN(C5=C4C=CC(=C5)Br)CCCN6C=CN=C6)N=C1

Isomeric SMILES

C1=CC2=C(C=CN2C3=C(C(=O)NC3=O)C4=CN(C5=C4C=CC(=C5)Br)CCCN6C=CN=C6)N=C1

InChI

InChI=1S/C25H19BrN6O2/c26-16-4-5-17-18(14-31(21(17)13-16)10-2-9-30-12-8-27-15-30)22-23(25(34)29-24(22)33)32-11-6-19-20(32)3-1-7-28-19/h1,3-8,11-15H,2,9-10H2,(H,29,33,34)