Vitas-M small molecule compound
N'-{(E)-[4-(1,3-benzothiazol-2-ylsulfanyl)-3-nitrophenyl]methylidene}-4-fluorobenzohydrazide
Catalog ID
STK751839
SMILES Fc1ccc(cc1)C(=O)N/N=C/c1ccc(c(c1)[N+](=O)[O-])Sc1nc2c(s1)cccc2
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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 C21H13FN4O3S2 MW 452.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13FN4O3S2/c22-15-8-6-14(7-9-15)20(27)25-23-12-13-5-10-19(17(11-13)26(28)29)31-21-24-16-3-1-2-4-18(16)30-21/h1-12H,(H,25,27)/b23-12+InChIKey
CZJIRZBAGNAKDG-FSJBWODESA-NSynonyms
C1=CC=C2C(=C1)N=C(S2)SC3=C(C=C(C=C3)C=NNC(=O)C4=CC=C(C=C4)F)(N+)(=O)(O)
Fc1ccc(cc1)C(=O)NN=Cc1ccc(c(c1)(N+)(=O)(O))Sc1nc2c(s1)cccc2
InChI=1SC21H13FN4O3S2c22158614(7915)20(27)2523121351019(17(1113)26(28)29)31212416312418(16)3021h112H(H2527)b2312+
MFCD00747726
N((E)(4(13benzothiazol2ylsulfanyl)3nitrophenyl)methylidene)4fluorobenzohydrazide
N((E)(4(13BENZOTHIAZOL2YLSULFANYL)3NITROPHENYL)METHYLIDENEAMINO)4FLUOROBENZAMIDE
ZINC000002176733
ZINC33349743
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