Vitas-M small molecule compound
2,3-bis{[4-ethyl-5-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}naphthalene-1,4-dione
Catalog ID
STK271823
SMILES CCn1c(nnc1c1ccc(cc1)C)SC1=C(Sc2nnc(n2CC)c2ccc(cc2)C)C(=O)c2c(C1=O)cccc2
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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 C32H28N6O2S2 MW 592.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28N6O2S2/c1-5-37-29(21-15-11-19(3)12-16-21)33-35-31(37)41-27-25(39)23-9-7-8-10-24(23)26(40)28(27)42-32-36-34-30(38(32)6-2)22-17-13-20(4)14-18-22/h7-18H,5-6H2,1-4H3InChIKey
RCDKWUZFHOECJK-UHFFFAOYSA-NSynonyms
23BIS((4ETHYL5(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)NAPHTHALENE14DIONE
23bis((4ethyl5(4methylphenyl)4H124triazol3yl)sulfanyl)naphthalene14dione
CCN1C(=NN=C1SC2=C(C(=O)C3=CC=CC=C3C2=O)SC4=NN=C(N4CC)C5=CC=C(C=C5)C)C6=CC=C(C=C6)C
InChI=1SC32H28N6O2S2c153729(21151119(3)121621)333531(37)412725(39)239781024(23)26(40)28(27)4232363430(38(32)62)22171320(4)141822h718H56H214H3
MFCD05855919
ZINC000098007133
ZINC98007133
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