3-(1H-indol-3-yl)-4-[1-[3-(methylamino)propyl]-4-methylsulfanyl-indol-3-yl]pyrrole-2,5-dione

Systemtic Name: 3-(1H-indol-3-yl)-4-[1-[3-(methylamino)propyl]-4-methylsulfanyl-indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-(1H-indol-3-yl)-4-[1-[3-(methylamino)propyl]-4-methylsulfanyl-indol-3-yl]pyrrole-2,5-dione CAS Name: 3-(1H-indol-3-yl)-4-[1-[3-(methylamino)propyl]-4-(methylthio)-3-indolyl]pyrrole-2,5-dione IUPAC Name: 3-(1H-indol-3-yl)-4-[1-[3-(methylamino)propyl]-4-methylsulfanylindol-3-yl]pyrrole-2,5-dione Traditional Name: 3-(1H-indol-3-yl)-4-[1-[3-(methylamino)propyl]-4-(methylthio)indol-3-yl]-3-pyrroline-2,5-quinone Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCN1C=C(C2=C1C=CC=C2SC)C3=C(C(=O)NC3=O)C4=CNC5=CC=CC=C54

Isomeric SMILES

CNCCCN1C=C(C2=C1C=CC=C2SC)C3=C(C(=O)NC3=O)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C25H24N4O2S/c1-26-11-6-12-29-14-17(21-19(29)9-5-10-20(21)32-2)23-22(24(30)28-25(23)31)16-13-27-18-8-4-3-7-15(16)18/h3-5,7-10,13-14,26-27H,6,11-12H2,1-2H3,(H,28,30,31)