Vitas-M small molecule compound
(2E)-N-benzyl-2-{[5-(2-bromo-4-nitrophenyl)furan-2-yl]methylidene}hydrazinecarbothioamide
Catalog ID
STK077643
SMILES S=C(NCc1ccccc1)N/N=C/c1ccc(o1)c1ccc(cc1Br)[N+](=O)[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 C19H15BrN4O3S MW 459.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15BrN4O3S/c20-17-10-14(24(25)26)6-8-16(17)18-9-7-15(27-18)12-22-23-19(28)21-11-13-4-2-1-3-5-13/h1-10,12H,11H2,(H2,21,23,28)/b22-12+InChIKey
BUNDIRYXUKWUOH-WSDLNYQXSA-NSynonyms
(2E)NBENZYL2((5(2BROMO4NITROPHENYL)FURAN2YL)METHYLIDENE)HYDRAZINECARBOTHIOAMIDE
1benzyl3((E)(5(2bromo4nitrophenyl)furan2yl)methylideneamino)thiourea
C1=CC=C(C=C1)CNC(=S)NN=CC2=CC=C(O2)C3=C(C=C(C=C3)(N+)(=O)(O))Br
InChI=1SC19H15BrN4O3Sc20171014(24(25)26)6816(17)189715(2718)12222319(28)2111134213513h11012H11H2(H2212328)b2212+
MFCD02205167
S=C(NCc1ccccc1)NN=Cc1ccc(o1)c1ccc(cc1Br)(N+)(=O)(O)
STK077643
ZINC000013899537
ZINC83309541
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