Vitas-M small molecule compound

N,N'-bis[(2Z)-3-methyl-1,3-benzothiazol-2(3H)-ylidene]-1-(4-nitrophenyl)methanediamine

Catalog ID
STK034857
SMILES [O-][N+](=O)c1ccc(cc1)C(/N=c/1\sc2c(n1C)cccc2)/N=c/1\sc2c(n1C)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 C23H19N5O2S2 MW 461.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N5O2S2/c1-26-17-7-3-5-9-19(17)31-22(26)24-21(15-11-13-16(14-12-15)28(29)30)25-23-27(2)18-8-4-6-10-20(18)32-23/h3-14,21H,1-2H3/b24-22-,25-23-
InChIKey
CDLQJVYSXFWMOJ-HKOLQMFGSA-N
Synonyms

(O)(N+)(=O)c1ccc(cc1)C(N=c1sc2c(n1C)cccc2)N=c1sc2c(n1C)cccc2
(Z)3methylN(((Z)(3methyl13benzothiazol2ylidene)amino)(4nitrophenyl)methyl)13benzothiazol2imine
2(((4NITROPHENYL)((3METHYL13BENZOTHIAZOL2(3H)YLIDENE)AMINO)METHYL)IMINO)3METHYL23DIHYDRO13BENZOTHIAZOLE
CN1C2=CC=CC=C2SC1=NC(C3=CC=C(C=C3)(N+)(=O)(O))N=C4N(C5=CC=CC=C5S4)C
InChI=1SC23H19N5O2S2c12617735919(17)3122(26)2421(15111316(141215)28(29)30)252327(2)188461020(18)3223h31421H12H3b24222523
MFCD01305002
NNBIS((2Z)3METHYL13BENZOTHIAZOL2(3H)YLIDENE)1(4NITROPHENYL)METHANEDIAMINE
STK034857
ZINC000100065924

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Available files

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