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

Systemtic Name: 3-[1-[3-(dimethylamino)-2-methoxy-propyl]-5-methylsulfanyl-indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione Openeye Name: 3-[1-[3-(dimethylamino)-2-methoxy-propyl]-5-methylsulfanyl-indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione CAS Name: 3-[1-[3-(dimethylamino)-2-methoxypropyl]-5-(methylthio)-3-indolyl]-4-(1H-indol-3-yl)pyrrole-2,5-dione IUPAC Name: 3-[1-[3-(dimethylamino)-2-methoxypropyl]-5-methylsulfanylindol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione Traditional Name: 3-[1-[3-(dimethylamino)-2-methoxy-propyl]-5-(methylthio)indol-3-yl]-4-(1H-indol-3-yl)-3-pyrroline-2,5-quinone Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(CN1C=C(C2=C1C=CC(=C2)SC)C3=C(C(=O)NC3=O)C4=CNC5=CC=CC=C54)OC

Isomeric SMILES

CN(C)CC(CN1C=C(C2=C1C=CC(=C2)SC)C3=C(C(=O)NC3=O)C4=CNC5=CC=CC=C54)OC

InChI

InChI=1S/C27H28N4O3S/c1-30(2)13-16(34-3)14-31-15-21(19-11-17(35-4)9-10-23(19)31)25-24(26(32)29-27(25)33)20-12-28-22-8-6-5-7-18(20)22/h5-12,15-16,28H,13-14H2,1-4H3,(H,29,32,33)