Vitas-M small molecule compound
(5Z)-2-[(2-chlorophenyl)amino]-5-(4-methoxy-3-nitrobenzylidene)-1,3-thiazol-4(5H)-one
Catalog ID
STL406869
SMILES COc1ccc(cc1[N+](=O)[O-])/C=C/1\SC(=NC1=O)Nc1ccccc1Cl
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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 C17H12ClN3O4S MW 389.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12ClN3O4S/c1-25-14-7-6-10(8-13(14)21(23)24)9-15-16(22)20-17(26-15)19-12-5-3-2-4-11(12)18/h2-9H,1H3,(H,19,20,22)/b15-9-InChIKey
NYNPXASOXLMVKG-DHDCSXOGSA-NSynonyms
(5Z)2((2chlorophenyl)amino)5(4methoxy3nitrobenzylidene)13thiazol4(5H)one
COC1=C(C=C(C=C1)C=C2C(=O)N=C(S2)NC3=CC=CC=C3Cl)(N+)(=O)(O)
COc1ccc(cc1(N+)(=O)(O))C=C1SC(=NC1=O)Nc1ccccc1Cl
InChI=1SC17H12ClN3O4Sc125147610(813(14)21(23)24)91516(22)2017(2615)1912532411(12)18h29H1H3(H192022)b159
MFCD07565861
ZINC000059566235
ZINC59566235
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