Vitas-M small molecule compound
3-[(Z)-(6-benzyl-3,7-dioxo-7H-[1,3]thiazolo[3,2-b][1,2,4]triazin-2(3H)-ylidene)methyl]phenyl acetate
Catalog ID
STK817282
SMILES CC(=O)Oc1cccc(c1)/C=c/1\sc2n(c1=O)nc(c(=O)n2)Cc1ccccc1
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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 C21H15N3O4S MW 405.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N3O4S/c1-13(25)28-16-9-5-8-15(10-16)12-18-20(27)24-21(29-18)22-19(26)17(23-24)11-14-6-3-2-4-7-14/h2-10,12H,11H2,1H3/b18-12-InChIKey
PHPOUZFFQNWEBF-PDGQHHTCSA-NSynonyms
606955-09-3(3((Z)(6BENZYL37DIOXO(13)THIAZOLO(32B)(124)TRIAZIN2YLIDENE)METHYL)PHENYL)ACETATE
(Z)3((6benzyl37dioxo37dihydro2Hthiazolo(32b)(124)triazin2ylidene)methyl)phenylacetate
3((Z)(6benzyl37dioxo7H(13)thiazolo(32b)(124)triazin2(3H)ylidene)methyl)phenylacetate
606955093
CC(=O)OC1=CC=CC(=C1)C=C2C(=O)N3C(=NC(=O)C(=N3)CC4=CC=CC=C4)S2
CC(=O)Oc1cccc(c1)C=c1sc2n(c1=O)nc(c(=O)n2)Cc1ccccc1
InChI=1SC21H15N3O4Sc113(25)281695815(1016)121820(27)2421(2918)2219(26)17(2324)11146324714h21012H11H21H3b1812
MFCD03498455
ZINC000013750967
ZINC13750967
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