3-(1-methylindol-3-yl)-4-[1-[3-(pyrimidin-2-ylamino)propyl]indol-3-yl]pyrrole-2,5-dione

Systemtic Name: 3-(1-methylindol-3-yl)-4-[1-[3-(pyrimidin-2-ylamino)propyl]indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-(1-methylindol-3-yl)-4-[1-[3-(pyrimidin-2-ylamino)propyl]indol-3-yl]pyrrole-2,5-dione CAS Name: 3-(1-methyl-3-indolyl)-4-[1-[3-(2-pyrimidinylamino)propyl]-3-indolyl]pyrrole-2,5-dione IUPAC Name: 3-(1-methylindol-3-yl)-4-[1-[3-(pyrimidin-2-ylamino)propyl]indol-3-yl]pyrrole-2,5-dione Traditional Name: 3-(1-methylindol-3-yl)-4-[1-[3-(2-pyrimidylamino)propyl]indol-3-yl]-3-pyrroline-2,5-quinone Formula: C28H24N6O2 MolecularWeight: 476.52916

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C3=C(C(=O)NC3=O)C4=CN(C5=CC=CC=C54)CCCNC6=NC=CC=N6

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C3=C(C(=O)NC3=O)C4=CN(C5=CC=CC=C54)CCCNC6=NC=CC=N6

InChI

InChI=1S/C28H24N6O2/c1-33-16-20(18-8-2-4-10-22(18)33)24-25(27(36)32-26(24)35)21-17-34(23-11-5-3-9-19(21)23)15-7-14-31-28-29-12-6-13-30-28/h2-6,8-13,16-17H,7,14-15H2,1H3,(H,29,30,31)(H,32,35,36)