Vitas-M small molecule compound
(3Z)-5-bromo-1-ethyl-3-[2-(2-methoxyphenyl)-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene]-1,3-dihydro-2H-indol-2-one
Catalog ID
STK801055
SMILES COc1ccccc1c1nc2n(n1)c(=O)/c(=C\1/C(=O)N(c3c1cc(Br)cc3)CC)/s2
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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 C21H15BrN4O3S MW 483.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15BrN4O3S/c1-3-25-14-9-8-11(22)10-13(14)16(19(25)27)17-20(28)26-21(30-17)23-18(24-26)12-6-4-5-7-15(12)29-2/h4-10H,3H2,1-2H3/b17-16-InChIKey
NXLUFAGRLJWBBQ-MSUUIHNZSA-NSynonyms
(3Z)5bromo1ethyl3(2(2methoxyphenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)13dihydro2Hindol2one
(5Z)5(5BROMO1ETHYL2OXOINDOL3YLIDENE)2(2METHOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)5(5bromo1ethyl2oxoindolin3ylidene)2(2methoxyphenyl)thiazolo(32b)(124)triazol6(5H)one
CCN1C2=C(C=C(C=C2)Br)C(=C3C(=O)N4C(=NC(=N4)C5=CC=CC=C5OC)S3)C1=O
COc1ccccc1c1nc2n(n1)c(=O)c(=C1C(=O)N(c3c1cc(Br)cc3)CC)s2
InChI=1SC21H15BrN4O3Sc1325149811(22)1013(14)16(19(25)27)1720(28)2621(3017)2318(2426)12645715(12)292h410H3H212H3b1716
MFCD04011085
ZINC000013510946
ZINC13510946
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