Vitas-M small molecule compound
2-{(5Z)-5-[4-(dimethylamino)benzylidene]-6-oxo-5,6-dihydro[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl}phenyl acetate
Catalog ID
STK818780
SMILES CC(=O)Oc1ccccc1c1nn2c(n1)s/c(=C\c1ccc(cc1)N(C)C)/c2=O
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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 C21H18N4O3S MW 406.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O3S/c1-13(26)28-17-7-5-4-6-16(17)19-22-21-25(23-19)20(27)18(29-21)12-14-8-10-15(11-9-14)24(2)3/h4-12H,1-3H3/b18-12-InChIKey
IGZSBCPKRISJOW-PDGQHHTCSA-NSynonyms
(2((5Z)5((4(dimethylamino)phenyl)methylidene)6oxo(13)thiazolo(32b)(124)triazol2yl)phenyl)acetate
(2((5Z)5((4DIMETHYLAMINOPHENYL)METHYLIDENE)6OXO(13)THIAZOLO(32B)(124)TRIAZOL2YL)PHENYL)ACETATE
2((5Z)5(4(dimethylamino)benzylidene)6oxo56dihydro(13)thiazolo(32b)(124)triazol2yl)phenylacetate
CC(=O)OC1=CC=CC=C1C2=NN3C(=O)C(=CC4=CC=C(C=C4)N(C)C)SC3=N2
CC(=O)Oc1ccccc1c1nn2c(n1)sc(=Cc1ccc(cc1)N(C)C)c2=O
InChI=1SC21H18N4O3Sc113(26)2817754616(17)19222125(2319)20(27)18(2921)121481015(11914)24(2)3h412H13H3b1812
MFCD03532995
ZINC000006363589
ZINC06363589
ZINC6363589
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