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

Systemtic Name: 3-[1-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-thiophen-3-yl-indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-[1-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(3-thienyl)indol-3-yl]pyrrole-2,5-dione CAS Name: 3-[1-[1-[3-(dimethylamino)propyl]-3-indazolyl]-4-(3-thiophenyl)-3-indolyl]pyrrole-2,5-dione IUPAC Name: 3-[1-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-thiophen-3-ylindol-3-yl]pyrrole-2,5-dione Traditional Name: 3-[1-[1-[3-(dimethylamino)propyl]indazol-3-yl]-4-(3-thienyl)indol-3-yl]-3-pyrroline-2,5-quinone Formula: C28H25N5O2S MolecularWeight: 495.5954

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C2=CC=CC=C2C(=N1)N3C=C(C4=C(C=CC=C43)C5=CSC=C5)C6=CC(=O)NC6=O

Isomeric SMILES

CN(C)CCCN1C2=CC=CC=C2C(=N1)N3C=C(C4=C(C=CC=C43)C5=CSC=C5)C6=CC(=O)NC6=O

InChI

InChI=1S/C28H25N5O2S/c1-31(2)12-6-13-33-23-9-4-3-7-20(23)27(30-33)32-16-22(21-15-25(34)29-28(21)35)26-19(8-5-10-24(26)32)18-11-14-36-17-18/h3-5,7-11,14-17H,6,12-13H2,1-2H3,(H,29,34,35)