Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enamide
Catalog ID
STK439095
SMILES O=C(Nc1scc(n1)c1ccc(cc1)[N+](=O)[O-])/C=C/c1ccc2c(c1)OCO2
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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 C19H13N3O5S MW 395.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13N3O5S/c23-18(8-2-12-1-7-16-17(9-12)27-11-26-16)21-19-20-15(10-28-19)13-3-5-14(6-4-13)22(24)25/h1-10H,11H2,(H,20,21,23)/b8-2+InChIKey
TVVSVIRQZZDPTJ-KRXBUXKQSA-NSynonyms
(2E)3(13benzodioxol5yl)N(4(4nitrophenyl)13thiazol2yl)prop2enamide
(2E)3(2HBENZO(D)13DIOXOLAN5YL)N(4(4NITROPHENYL)(13THIAZOL2YL))PROP2ENAMIDE
(E)3(13BENZODIOXOL5YL)N(4(4NITROPHENYL)13THIAZOL2YL)PROP2ENAMIDE
3(13BENZODIOXOL5YL)N(4(4NITROPHENYL)13THIAZOL2YL)ACRYLAMIDE
C1OC2=C(O1)C=C(C=C2)C=CC(=O)NC3=NC(=CS3)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC19H13N3O5Sc2318(8212171617(912)27112616)21192015(102819)133514(6413)22(24)25h110H11H2(H202123)b82+
MFCD01350857
O=C(Nc1scc(n1)c1ccc(cc1)(N+)(=O)(O))C=Cc1ccc2c(c1)OCO2
ZINC000000996664
ZINC00996664
ZINC996664
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