methyl 4-[2-[[3-(4-methoxy-4-oxidanylidene-butyl)-1H-indol-2-yl]disulfanyl]-1H-indol-3-yl]butanoate

Systemtic Name: methyl 4-[2-[[3-(4-methoxy-4-oxidanylidene-butyl)-1H-indol-2-yl]disulfanyl]-1H-indol-3-yl]butanoate Openeye Name: methyl 4-[2-[[3-(4-methoxy-4-oxo-butyl)-1H-indol-2-yl]disulfanyl]-1H-indol-3-yl]butanoate CAS Name: 4-[2-[[3-(4-methoxy-4-oxobutyl)-1H-indol-2-yl]disulfanyl]-1H-indol-3-yl]butanoic acid methyl ester IUPAC Name: methyl 4-[2-[[3-(4-methoxy-4-oxobutyl)-1H-indol-2-yl]disulfanyl]-1H-indol-3-yl]butanoate Traditional Name: 4-[2-[[3-(4-keto-4-methoxy-butyl)-1H-indol-2-yl]disulfanyl]-1H-indol-3-yl]butyric acid methyl ester Formula: C26H28N2O4S2 MolecularWeight: 496.64152

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=C(NC2=CC=CC=C21)SSC3=C(C4=CC=CC=C4N3)CCCC(=O)OC

Isomeric SMILES

COC(=O)CCCC1=C(NC2=CC=CC=C21)SSC3=C(C4=CC=CC=C4N3)CCCC(=O)OC

InChI

InChI=1S/C26H28N2O4S2/c1-31-23(29)15-7-11-19-17-9-3-5-13-21(17)27-25(19)33-34-26-20(12-8-16-24(30)32-2)18-10-4-6-14-22(18)28-26/h3-6,9-10,13-14,27-28H,7-8,11-12,15-16H2,1-2H3