Vitas-M small molecule compound
2-ethoxy-4-[(Z)-(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]phenyl thiophene-2-carboxylate
Catalog ID
STL418964
SMILES CCOc1cc(ccc1OC(=O)c1cccs1)/C=c/1\sc2n(c1=O)c1c(n2)cccc1
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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 C23H16N2O4S2 MW 448.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16N2O4S2/c1-2-28-18-12-14(9-10-17(18)29-22(27)19-8-5-11-30-19)13-20-21(26)25-16-7-4-3-6-15(16)24-23(25)31-20/h3-13H,2H2,1H3/b20-13-InChIKey
KJMJZSHIKSIVKM-MOSHPQCFSA-NSynonyms
(2ETHOXY4((Z)(1OXO(13)THIAZOLO(32A)BENZIMIDAZOL2YLIDENE)METHYL)PHENYL)THIOPHENE2CARBOXYLATE
2ethoxy4((Z)(3oxo(13)thiazolo(32a)benzimidazol2(3H)ylidene)methyl)phenylthiophene2carboxylate
CCOC1=C(C=CC(=C1)C=C2C(=O)N3C4=CC=CC=C4N=C3S2)OC(=O)C5=CC=CS5
CCOc1cc(ccc1OC(=O)c1cccs1)C=c1sc2n(c1=O)c1c(n2)cccc1
InChI=1SC23H16N2O4S2c1228181214(91017(18)2922(27)1985113019)132021(26)2516743615(16)2423(25)3120h313H2H21H3b2013
MFCD03706659
ZINC000015012090
ZINC15012090
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