Vitas-M small molecule compound
(5Z)-2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-[(2-methyl-2H-chromen-3-yl)methylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK515871
SMILES COc1cc(/C=C/c2nn3c(n2)s/c(=C\C2=Cc4ccccc4OC2C)/c3=O)ccc1OC
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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 C25H21N3O4S MW 459.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O4S/c1-15-18(13-17-6-4-5-7-19(17)32-15)14-22-24(29)28-25(33-22)26-23(27-28)11-9-16-8-10-20(30-2)21(12-16)31-3/h4-15H,1-3H3/b11-9+,22-14-InChIKey
ZQGPRYGLCVEJGT-BGNXJKKVSA-NSynonyms
(5Z)2((E)2(34dimethoxyphenyl)ethenyl)5((2methyl2Hchromen3yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2((E)2(34dimethoxyphenyl)ethenyl)5((2methyl2Hchromen3yl)methylidene)(13)thiazolo(32b)(124)triazol6one
CC1C(=CC2=CC=CC=C2O1)C=C3C(=O)N4C(=NC(=N4)C=CC5=CC(=C(C=C5)OC)OC)S3
COc1cc(C=Cc2nn3c(n2)sc(=CC2=Cc4ccccc4OC2C)c3=O)ccc1OC
InChI=1SC25H21N3O4Sc11518(1317645719(17)3215)142224(29)2825(3322)2623(2728)1191681020(302)21(1216)313h415H13H3b119+2214
MFCD06645417
ZINC000016742091
ZINC000016742092
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