Vitas-M small molecule compound
N-[(4E)-2-(1,3-benzodioxol-5-yl)-4H-chromen-4-ylidene]-4-(3,4-dimethoxyphenyl)-5-methyl-1,3-thiazol-2-amine
Catalog ID
STK581561
SMILES COc1cc(ccc1OC)c1nc(sc1C)/N=c/1\cc(oc2c1cccc2)c1ccc2c(c1)OCO2
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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 C28H22N2O5S MW 498.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N2O5S/c1-16-27(18-9-10-22(31-2)25(13-18)32-3)30-28(36-16)29-20-14-24(35-21-7-5-4-6-19(20)21)17-8-11-23-26(12-17)34-15-33-23/h4-14H,15H2,1-3H3/b29-20+InChIKey
TVLNXCWTFMYZDC-ZTKZIYFRSA-NSynonyms
898915-25-8(E)2(13benzodioxol5yl)N(4(34dimethoxyphenyl)5methyl13thiazol2yl)chromen4imine
(E)N(2(benzo(d)(13)dioxol5yl)4Hchromen4ylidene)4(34dimethoxyphenyl)5methylthiazol2amine
898915258
CC1=C(N=C(S1)N=C2C=C(OC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)C6=CC(=C(C=C6)OC)OC
COc1cc(ccc1OC)c1nc(sc1C)N=c1cc(oc2c1cccc2)c1ccc2c(c1)OCO2
InChI=1SC28H22N2O5Sc11627(1891022(312)25(1318)323)3028(3616)29201424(3521754619(20)21)178112326(1217)34153323h414H15H213H3b2920+
MFCD07639504
N((4E)2(13benzodioxol5yl)4Hchromen4ylidene)4(34dimethoxyphenyl)5methyl13thiazol2amine
ZINC000009128980
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