Vitas-M small molecule compound
2-(4-chlorophenoxy)-N'-{(E)-[3-nitro-4-(4H-1,2,4-triazol-3-ylsulfanyl)phenyl]methylidene}acetohydrazide
Catalog ID
STK699421
SMILES O=C(COc1ccc(cc1)Cl)N/N=C/c1ccc(c(c1)[N+](=O)[O-])Sc1nnc[nH]1
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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 C17H13ClN6O4S MW 432.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13ClN6O4S/c18-12-2-4-13(5-3-12)28-9-16(25)22-20-8-11-1-6-15(14(7-11)24(26)27)29-17-19-10-21-23-17/h1-8,10H,9H2,(H,22,25)(H,19,21,23)/b20-8+InChIKey
CGBSSNGKFNKHOW-DNTJNYDQSA-NSynonyms
2(4CHLOROPHENOXY)N((E)(3NITRO4(1H124TRIAZOL5YLSULFANYL)PHENYL)METHYLIDENEAMINO)ACETAMIDE
2(4chlorophenoxy)N((E)(3nitro4(4H124triazol3ylsulfanyl)phenyl)methylidene)acetohydrazide
C1=CC(=CC=C1OCC(=O)NN=CC2=CC(=C(C=C2)SC3=NC=NN3)(N+)(=O)(O))Cl
InChI=1SC17H13ClN6O4Sc18122413(5312)28916(25)22208111615(14(711)24(26)27)29171910212317h1810H9H2(H2225)(H192123)b208+
MFCD04178745
N(4((4H124triazol3yl)thio)3nitrobenzylidene)2(4chlorophenoxy)acetohydrazide
O=C(COc1ccc(cc1)Cl)NN=Cc1ccc(c(c1)(N+)(=O)(O))Sc1nnc(nH)1
ZINC000001873691
ZINC33345683
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