3-(6-chloranyl-1-pyridin-3-yl-indol-3-yl)-4-[1-[3-(dimethylamino)propyl]indazol-3-yl]pyrrole-2,5-dione

Systemtic Name: 3-(6-chloranyl-1-pyridin-3-yl-indol-3-yl)-4-[1-[3-(dimethylamino)propyl]indazol-3-yl]pyrrole-2,5-dione Openeye Name: 3-[6-chloro-1-(3-pyridyl)indol-3-yl]-4-[1-[3-(dimethylamino)propyl]indazol-3-yl]pyrrole-2,5-dione CAS Name: 3-[6-chloro-1-(3-pyridinyl)-3-indolyl]-4-[1-[3-(dimethylamino)propyl]-3-indazolyl]pyrrole-2,5-dione IUPAC Name: 3-(6-chloro-1-pyridin-3-ylindol-3-yl)-4-[1-[3-(dimethylamino)propyl]indazol-3-yl]pyrrole-2,5-dione Traditional Name: 3-[6-chloro-1-(3-pyridyl)indol-3-yl]-4-[1-[3-(dimethylamino)propyl]indazol-3-yl]-3-pyrroline-2,5-quinone Formula: C29H25ClN6O2 MolecularWeight: 525.0008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C2=CC=CC=C2C(=N1)C3=C(C(=O)NC3=O)C4=CN(C5=C4C=CC(=C5)Cl)C6=CN=CC=C6

Isomeric SMILES

CN(C)CCCN1C2=CC=CC=C2C(=N1)C3=C(C(=O)NC3=O)C4=CN(C5=C4C=CC(=C5)Cl)C6=CN=CC=C6

InChI

InChI=1S/C29H25ClN6O2/c1-34(2)13-6-14-36-23-9-4-3-8-21(23)27(33-36)26-25(28(37)32-29(26)38)22-17-35(19-7-5-12-31-16-19)24-15-18(30)10-11-20(22)24/h3-5,7-12,15-17H,6,13-14H2,1-2H3,(H,32,37,38)