Vitas-M small molecule compound

(2E,2'E)-4,4'-[oxybis(benzene-4,1-diylsulfanediylbenzene-4,1-diylimino)]bis(4-oxobut-2-enoic acid)

Catalog ID
STK045118
SMILES O=C(Nc1ccc(cc1)Sc1ccc(cc1)Oc1ccc(cc1)Sc1ccc(cc1)NC(=O)/C=C/C(=O)O)/C=C/C(=O)O

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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 C32H24N2O7S2 MW 612.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H24N2O7S2/c35-29(17-19-31(37)38)33-21-1-9-25(10-2-21)42-27-13-5-23(6-14-27)41-24-7-15-28(16-8-24)43-26-11-3-22(4-12-26)34-30(36)18-20-32(39)40/h1-20H,(H,33,35)(H,34,36)(H,37,38)(H,39,40)/b19-17+,20-18+
InChIKey
FZPNFXFNOHYAEF-XPWSMXQVSA-N
Synonyms

(2E2E)44(OXYBIS(BENZENE41DIYLSULFANEDIYLBENZENE41DIYLIMINO))BIS(4OXOBUT2ENOICACID)
(E)4(4(4(4(4(((E)3carboxyprop2enoyl)amino)phenyl)sulfanylphenoxy)phenyl)sulfanylanilino)4oxobut2enoicacid
(E)4(4(4(4(4(((E)4HYDROXY4OXOBUT2ENOYL)AMINO)PHENYL)SULFANYLPHENOXY)PHENYL)SULFANYLANILINO)4OXOBUT2ENOICACID
C1=CC(=CC=C1NC(=O)C=CC(=O)O)SC2=CC=C(C=C2)OC3=CC=C(C=C3)SC4=CC=C(C=C4)NC(=O)C=CC(=O)O
InChI=1SC32H24N2O7S2c3529(171931(37)38)33211925(10221)422713523(61427)412471528(16824)432611322(41226)3430(36)182032(39)40h120H(H3335)(H3436)(H3738)(H3940)b1917+2018+
MFCD00305949
O=C(Nc1ccc(cc1)Sc1ccc(cc1)Oc1ccc(cc1)Sc1ccc(cc1)NC(=O)C=CC(=O)O)C=CC(=O)O
STK045118
ZINC000097958602
ZINC97958602

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Available files

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