Vitas-M small molecule compound
2-[(5Z)-5-(3-bromobenzylidene)-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl]phenyl acetate
Catalog ID
STK818773
SMILES CC(=O)Oc1ccccc1c1nc2n(n1)c(=O)/c(=C/c1cccc(c1)Br)/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 C19H12BrN3O3S MW 442.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12BrN3O3S/c1-11(24)26-15-8-3-2-7-14(15)17-21-19-23(22-17)18(25)16(27-19)10-12-5-4-6-13(20)9-12/h2-10H,1H3/b16-10-InChIKey
SKLWIYZRPIMOGM-YBEGLDIGSA-NSynonyms
(2((5Z)5((3BROMOPHENYL)METHYLIDENE)6OXO(13)THIAZOLO(32B)(124)TRIAZOL2YL)PHENYL)ACETATE
2((5Z)5(3bromobenzylidene)6oxo56dihydro(13)thiazolo(32b)(124)triazol2yl)phenylacetate
CC(=O)OC1=CC=CC=C1C2=NN3C(=O)C(=CC4=CC(=CC=C4)Br)SC3=N2
CC(=O)Oc1ccccc1c1nc2n(n1)c(=O)c(=Cc1cccc(c1)Br)s2
InChI=1SC19H12BrN3O3Sc111(24)2615832714(15)17211923(2217)18(25)16(2719)101254613(20)912h210H1H3b1610
MFCD03532881
ZINC000016737001
ZINC16737001
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