Vitas-M small molecule compound
(2E)-N-[5-(3-chlorobenzyl)-1,3-thiazol-2-yl]-2-cyano-3-(3-nitrophenyl)prop-2-enamide
Catalog ID
STL017007
SMILES N#C/C(=C\c1cccc(c1)[N+](=O)[O-])/C(=O)Nc1ncc(s1)Cc1cccc(c1)Cl
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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 C20H13ClN4O3S MW 424.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13ClN4O3S/c21-16-5-1-3-14(8-16)10-18-12-23-20(29-18)24-19(26)15(11-22)7-13-4-2-6-17(9-13)25(27)28/h1-9,12H,10H2,(H,23,24,26)/b15-7+InChIKey
FQFKLJKYZDQUJM-VIZOYTHASA-NSynonyms
(2E)N(5((3CHLOROPHENYL)METHYL)(13THIAZOL2YL))2CYANO3(3NITROPHENYL)PROP2ENAMIDE
(2E)N(5(3chlorobenzyl)13thiazol2yl)2cyano3(3nitrophenyl)prop2enamide
(E)N(5((3CHLOROPHENYL)METHYL)13THIAZOL2YL)2CYANO3(3NITROPHENYL)PROP2ENAMIDE
C1=CC(=CC(=C1)Cl)CC2=CN=C(S2)NC(=O)C(=CC3=CC(=CC=C3)(N+)(=O)(O))C#N
InChI=1SC20H13ClN4O3Sc211651314(816)1018122320(2918)2419(26)15(1122)71342617(913)25(27)28h1912H10H2(H232426)b157+
MFCD02979236
N#CC(=Cc1cccc(c1)(N+)(=O)(O))C(=O)Nc1ncc(s1)Cc1cccc(c1)Cl
ZINC000000954215
ZINC00954215
ZINC954215
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