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

Systemtic Name: 3-(1H-indol-3-yl)-4-[5-methylsulfanyl-1-(3-oxidanylpropyl)indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-[1-(3-hydroxypropyl)-5-methylsulfanyl-indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione CAS Name: 3-[1-(3-hydroxypropyl)-5-(methylthio)-3-indolyl]-4-(1H-indol-3-yl)pyrrole-2,5-dione IUPAC Name: 3-[1-(3-hydroxypropyl)-5-methylsulfanylindol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione Traditional Name: 3-[1-(3-hydroxypropyl)-5-(methylthio)indol-3-yl]-4-(1H-indol-3-yl)-3-pyrroline-2,5-quinone Formula: C24H21N3O3S MolecularWeight: 431.50684

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)N(C=C2C3=C(C(=O)NC3=O)C4=CNC5=CC=CC=C54)CCCO

Isomeric SMILES

CSC1=CC2=C(C=C1)N(C=C2C3=C(C(=O)NC3=O)C4=CNC5=CC=CC=C54)CCCO

InChI

InChI=1S/C24H21N3O3S/c1-31-14-7-8-20-16(11-14)18(13-27(20)9-4-10-28)22-21(23(29)26-24(22)30)17-12-25-19-6-3-2-5-15(17)19/h2-3,5-8,11-13,25,28H,4,9-10H2,1H3,(H,26,29,30)