Vitas-M small molecule compound

6-({[1-(4-fluorophenyl)-1H-tetrazol-5-yl]sulfanyl}methyl)-N,N-dimethyl-1,3,5-triazine-2,4-diamine

Catalog ID
STK734651
SMILES Nc1nc(CSc2nnnn2c2ccc(cc2)F)nc(n1)N(C)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 C13H14FN9S MW 347.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14FN9S/c1-22(2)12-17-10(16-11(15)18-12)7-24-13-19-20-21-23(13)9-5-3-8(14)4-6-9/h3-6H,7H2,1-2H3,(H2,15,16,17,18)
InChIKey
VCNPCMAGVUNGHH-UHFFFAOYSA-N
Synonyms

(135)TRIAZINE24DIAMINE6(1(4FLUOROPHENYL)1HTETRAZOL5YLSULFANYLMETHYL)NNDIMETHYL
(4AMINO6(((1(4FLUOROPHENYL)TETRAZOL5YL)THIO)METHYL)STRIAZIN2YL)DIMETHYLAMINE
6(((1(4fluorophenyl)1Htetrazol5yl)sulfanyl)methyl)NNdimethyl135triazine24diamine
6(((1(4FLUOROPHENYL)1HTETRAZOL5YL)THIO)METHYL)NNDIMETHYL135TRIAZINE24DIAMINE
6(((1(4FLUOROPHENYL)5TETRAZOLYL)THIO)METHYL)N2N2DIMETHYL135TRIAZINE24DIAMINE
6((1(4FLUOROPHENYL)TETRAZOL5YL)SULFANYLMETHYL)2N2NDIMETHYL135TRIAZINE24DIAMINE
CN(C)C1=NC(=NC(=N1)N)CSC2=NN=NN2C3=CC=C(C=C3)F
InChI=1SC13H14FN9Sc122(2)121710(1611(15)1812)7241319202123(13)9538(14)469h36H7H212H3(H215161718)
MFCD05259157
ZINC000000615872
ZINC00615872
ZINC615872

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Available files

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