Vitas-M small molecule compound
(5Z)-5-{3-chloro-4-[(4-nitrobenzyl)oxy]benzylidene}-3-methyl-2-thioxoimidazolidin-4-one
Catalog ID
STL369119
SMILES S=C1N/C(=C\c2ccc(c(c2)Cl)OCc2ccc(cc2)[N+](=O)[O-])/C(=O)N1C
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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 C18H14ClN3O4S MW 403.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14ClN3O4S/c1-21-17(23)15(20-18(21)27)9-12-4-7-16(14(19)8-12)26-10-11-2-5-13(6-3-11)22(24)25/h2-9H,10H2,1H3,(H,20,27)/b15-9-InChIKey
AHNHUUODYFKCRF-DHDCSXOGSA-NSynonyms
(5Z)5((3CHLORO4((4NITROPHENYL)METHOXY)PHENYL)METHYLIDENE)3METHYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(3chloro4((4nitrobenzyl)oxy)benzylidene)3methyl2thioxoimidazolidin4one
CN1C(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)(N+)(=O)(O))Cl)NC1=S
InChI=1SC18H14ClN3O4Sc12117(23)15(2018(21)27)9124716(14(19)812)2610112513(6311)22(24)25h29H10H21H3(H2027)b159
MFCD03138135
S=C1NC(=Cc2ccc(c(c2)Cl)OCc2ccc(cc2)(N+)(=O)(O))C(=O)N1C
ZINC000004754415
ZINC04754415
ZINC4754415
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