3-(1-methyl-6-methylsulfanyl-indol-3-yl)-4-(1-methyl-6-nitro-indol-3-yl)pyrrole-2,5-dione

Systemtic Name: 3-(1-methyl-6-methylsulfanyl-indol-3-yl)-4-(1-methyl-6-nitro-indol-3-yl)pyrrole-2,5-dione Openeye Name: 3-(1-methyl-6-methylsulfanyl-indol-3-yl)-4-(1-methyl-6-nitro-indol-3-yl)pyrrole-2,5-dione CAS Name: 3-[1-methyl-6-(methylthio)-3-indolyl]-4-(1-methyl-6-nitro-3-indolyl)pyrrole-2,5-dione IUPAC Name: 3-(1-methyl-6-methylsulfanylindol-3-yl)-4-(1-methyl-6-nitroindol-3-yl)pyrrole-2,5-dione Traditional Name: 3-[1-methyl-6-(methylthio)indol-3-yl]-4-(1-methyl-6-nitro-indol-3-yl)-3-pyrroline-2,5-quinone Formula: C23H18N4O4S MolecularWeight: 446.47842

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=C(C=C2)[N+](=O)[O-])C3=C(C(=O)NC3=O)C4=CN(C5=C4C=CC(=C5)SC)C

Isomeric SMILES

CN1C=C(C2=C1C=C(C=C2)[N+](=O)[O-])C3=C(C(=O)NC3=O)C4=CN(C5=C4C=CC(=C5)SC)C

InChI

InChI=1S/C23H18N4O4S/c1-25-10-16(14-6-4-12(27(30)31)8-18(14)25)20-21(23(29)24-22(20)28)17-11-26(2)19-9-13(32-3)5-7-15(17)19/h4-11H,1-3H3,(H,24,28,29)