Vitas-M small molecule compound
(3Z)-5-bromo-1-butyl-3-[2-(3,4-dimethoxyphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1,3-dihydro-2H-indol-2-one
Catalog ID
STK819585
SMILES CCCCN1C(=O)/C(=c/2\sc3n(c2=O)nc(n3)c2ccc(c(c2)OC)OC)/c2c1ccc(c2)Br
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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 C24H21BrN4O4S MW 541.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21BrN4O4S/c1-4-5-10-28-16-8-7-14(25)12-15(16)19(22(28)30)20-23(31)29-24(34-20)26-21(27-29)13-6-9-17(32-2)18(11-13)33-3/h6-9,11-12H,4-5,10H2,1-3H3/b20-19-InChIKey
YNEXDNPPDSJBNS-VXPUYCOJSA-NSynonyms
(3Z)5bromo1butyl3(2(34dimethoxyphenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)13dihydro2Hindol2one
(5Z)5(5bromo1butyl2oxoindol3ylidene)2(34dimethoxyphenyl)(13)thiazolo(32b)(124)triazol6one
CCCCN1C(=O)C(=c2sc3n(c2=O)nc(n3)c2ccc(c(c2)OC)OC)c2c1ccc(c2)Br
CCCCN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N4C(=NC(=N4)C5=CC(=C(C=C5)OC)OC)S3)C1=O
InChI=1SC24H21BrN4O4Sc1451028168714(25)1215(16)19(22(28)30)2023(31)2924(3420)2621(2729)136917(322)18(1113)333h691112H4510H213H3b2019
MFCD06285245
ZINC000097959809
ZINC97959809
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