Vitas-M small molecule compound
1,5-bis[(4-octylphenyl)sulfanyl]anthracene-9,10-dione
Catalog ID
STK076288
SMILES CCCCCCCCc1ccc(cc1)Sc1cccc2c1C(=O)c1c(C2=O)c(ccc1)Sc1ccc(cc1)CCCCCCCC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C42H48O2S2 MW 648.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C42H48O2S2/c1-3-5-7-9-11-13-17-31-23-27-33(28-24-31)45-37-21-15-19-35-39(37)41(43)36-20-16-22-38(40(36)42(35)44)46-34-29-25-32(26-30-34)18-14-12-10-8-6-4-2/h15-16,19-30H,3-14,17-18H2,1-2H3InChIKey
FXGHHHAGSCOLKV-UHFFFAOYSA-NSynonyms
15BIS((4OCTYLPHENYL)SULFANYL)ANTHRACENE910DIONE
CCCCCCCCC1=CC=C(C=C1)SC2=CC=CC3=C2C(=O)C4=C(C3=O)C(=CC=C4)SC5=CC=C(C=C5)CCCCCCCC
CCCCCCCCc1ccc(cc1)Sc1cccc2c1C(=O)c1c(C2=O)c(ccc1)Sc1ccc(cc1)CCCCCCCC
InChI=1SC42H48O2S2c1357911131731232733(282431)45372115193539(37)41(43)3620162238(40(36)42(35)44)4634292532(263034)181412108642h15161930H3141718H212H3
MFCD00805200
STK076288
ZINC000097996986
ZINC97996986
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