Vitas-M small molecule compound
(2Z)-6-benzyl-2-(5-bromo-2-methoxybenzylidene)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Catalog ID
STK815750
SMILES COc1ccc(cc1/C=c/1\sc2n(c1=O)nc(c(=O)n2)Cc1ccccc1)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 C20H14BrN3O3S MW 456.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14BrN3O3S/c1-27-16-8-7-14(21)10-13(16)11-17-19(26)24-20(28-17)22-18(25)15(23-24)9-12-5-3-2-4-6-12/h2-8,10-11H,9H2,1H3/b17-11-InChIKey
SPSMLZUKNIEBNV-BOPFTXTBSA-NSynonyms
(2Z)6BENZYL2((5BROMO2METHOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2Z)6benzyl2(5bromo2methoxybenzylidene)7H(13)thiazolo(32b)(124)triazine37(2H)dione
COC1=C(C=C(C=C1)Br)C=C2C(=O)N3C(=NC(=O)C(=N3)CC4=CC=CC=C4)S2
COc1ccc(cc1C=c1sc2n(c1=O)nc(c(=O)n2)Cc1ccccc1)Br
InChI=1SC20H14BrN3O3Sc127168714(21)1013(16)111719(26)2420(2817)2218(25)15(2324)9125324612h281011H9H21H3b1711
MFCD03533615
ZINC000016732757
ZINC16732757
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