Vitas-M small molecule compound

methyl 1-[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-5-methyl-1H-1,2,3-triazole-4-carboxylate

Catalog ID
STK774683
SMILES COC(=O)c1nnn(c1C)c1nc(nc(n1)N(C)C)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 C12H18N8O2 MW 306.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N8O2/c1-7-8(9(21)22-6)16-17-20(7)12-14-10(18(2)3)13-11(15-12)19(4)5/h1-6H3
InChIKey
QYKIELVGYMIYDR-UHFFFAOYSA-N
Synonyms

1H(123)TRIAZOLE4CARBOXYLICACID1(46BISDIMETHYLAMINO(135)TRIAZIN2YL)5METHYLMETHYLESTER
CC1=C(N=NN1C2=NC(=NC(=N2)N(C)C)N(C)C)C(=O)OC
InChI=1SC12H18N8O2c178(9(21)226)161720(7)121410(18(2)3)1311(1512)19(4)5h16H3
methyl1(46bis(dimethylamino)135triazin2yl)5methyl1H123triazole4carboxylate
METHYL1(46BIS(DIMETHYLAMINO)135TRIAZIN2YL)5METHYLTRIAZOLE4CARBOXYLATE
MFCD04061136
ZINC000001446068
ZINC01446068
ZINC1446068

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Available files

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