Vitas-M small molecule compound

2-(1,3-benzothiazol-2-ylsulfanyl)-N'-{(E)-[4-(2-cyano-4-nitrophenoxy)phenyl]methylidene}acetohydrazide

Catalog ID
STL383332
SMILES N#Cc1cc(ccc1Oc1ccc(cc1)/C=N/NC(=O)CSc1nc2c(s1)cccc2)[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 C23H15N5O4S2 MW 489.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15N5O4S2/c24-12-16-11-17(28(30)31)7-10-20(16)32-18-8-5-15(6-9-18)13-25-27-22(29)14-33-23-26-19-3-1-2-4-21(19)34-23/h1-11,13H,14H2,(H,27,29)/b25-13+
InChIKey
VXPKHPDKTZPLHI-DHRITJCHSA-N
Synonyms
494757-27-6
2(13benzothiazol2ylsulfanyl)N((E)(4(2cyano4nitrophenoxy)phenyl)methylidene)acetohydrazide
2(13benzothiazol2ylsulfanyl)N((E)(4(2cyano4nitrophenoxy)phenyl)methylideneamino)acetamide
2(13BENZOTHIAZOL2YLSULFANYL)N(4(2CYANO4NITROPHENOXY)BENZYLIDENE)ACETOHYDRAZIDE
C1=CC=C2C(=C1)N=C(S2)SCC(=O)NN=CC3=CC=C(C=C3)OC4=C(C=C(C=C4)(N+)(=O)(O))C#N
N#Cc1cc(ccc1Oc1ccc(cc1)C=NNC(=O)CSc1nc2c(s1)cccc2)(N+)(=O)(O)
Registry IDs
MFCD02609220
ZINC000002801572
ZINC33761359

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Available files

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