Vitas-M small molecule compound

methyl {[4-(tert-butylamino)-6-(dimethylamino)-1,3,5-triazin-2-yl]sulfanyl}acetate

Catalog ID
STL440841
SMILES COC(=O)CSc1nc(nc(n1)N(C)C)NC(C)(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 C12H21N5O2S MW 299.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H21N5O2S/c1-12(2,3)16-9-13-10(17(4)5)15-11(14-9)20-7-8(18)19-6/h7H2,1-6H3,(H,13,14,15,16)
InChIKey
VCSSAEGQNRCKPL-UHFFFAOYSA-N
Synonyms

CC(C)(C)NC1=NC(=NC(=N1)SCC(=O)OC)N(C)C
InChI=1SC12H21N5O2Sc112(23)1691310(17(4)5)1511(149)2078(18)196h7H216H3(H13141516)
methyl((4(tertbutylamino)6(dimethylamino)135triazin2yl)sulfanyl)acetate
METHYL((4(TERTBUTYLAMINO)6(DIMETHYLAMINO)135TRIAZIN2YL)THIO)ACETATE
METHYL2((4(TERTBUTYLAMINO)6(DIMETHYLAMINO)135TRIAZIN2YL)SULFANYL)ACETATE
MFCD05240823
ZINC000000804337
ZINC00804337
ZINC804337

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Available files

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