3-[3-(1H-imidazol-2-ylmethylamino)phenyl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione

Systemtic Name: 3-[3-(1H-imidazol-2-ylmethylamino)phenyl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione Openeye Name: 3-[3-(1H-imidazol-2-ylmethylamino)phenyl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione CAS Name: 3-[3-(1H-imidazol-2-ylmethylamino)phenyl]-4-(1-methyl-3-indolyl)pyrrole-2,5-dione IUPAC Name: 3-[3-(1H-imidazol-2-ylmethylamino)phenyl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione Traditional Name: 3-[3-(1H-imidazol-2-ylmethylamino)phenyl]-4-(1-methylindol-3-yl)-3-pyrroline-2,5-quinone Formula: C23H19N5O2 MolecularWeight: 397.42926

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C3=C(C(=O)NC3=O)C4=CC(=CC=C4)NCC5=NC=CN5

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C3=C(C(=O)NC3=O)C4=CC(=CC=C4)NCC5=NC=CN5

InChI

InChI=1S/C23H19N5O2/c1-28-13-17(16-7-2-3-8-18(16)28)21-20(22(29)27-23(21)30)14-5-4-6-15(11-14)26-12-19-24-9-10-25-19/h2-11,13,26H,12H2,1H3,(H,24,25)(H,27,29,30)