Vitas-M small molecule compound

N,N'-bis(4-methoxyphenyl)-6-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,5-triazine-2,4-diamine

Catalog ID
STK066677
SMILES COc1ccc(cc1)Nc1nc(Nc2ccc(cc2)OC)nc(n1)Sc1nnc(s1)C

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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 C20H19N7O2S2 MW 453.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N7O2S2/c1-12-26-27-20(30-12)31-19-24-17(21-13-4-8-15(28-2)9-5-13)23-18(25-19)22-14-6-10-16(29-3)11-7-14/h4-11H,1-3H3,(H2,21,22,23,24,25)
InChIKey
AJCNOBWLDJRIPV-UHFFFAOYSA-N
Synonyms
298687-53-3
(4METHOXYPHENYL)(4((4METHOXYPHENYL)AMINO)6(5METHYL(134THIADIAZOL2YL)THIO)(135TRIAZIN2YL))AMINE
298687533
2N4NBIS(4METHOXYPHENYL)6((5METHYL134THIADIAZOL2YL)SULFANYL)135TRIAZINE24DIAMINE
CC1=NN=C(S1)SC2=NC(=NC(=N2)NC3=CC=C(C=C3)OC)NC4=CC=C(C=C4)OC
COc1ccc(cc1)Nc1nc(Nc2ccc(cc2)OC)nc(n1)Sc1nnc(s1)C
InChI=1SC20H19N7O2S2c112262720(3012)31192417(21134815(282)9513)2318(2519)221461016(293)11714h411H13H3(H22122232425)
MFCD01565454
N2N4bis(4methoxyphenyl)6((5methyl134thiadiazol2yl)thio)135triazine24diamine
NNBIS(4METHOXYPHENYL)6((5METHYL134THIADIAZOL2YL)SULFANYL)135TRIAZINE24DIAMINE
STK066677
ZINC000002185921
ZINC02185921
ZINC2185921

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.