Vitas-M small molecule compound

2,2'-[(8,8-dimethyl-7,10-dihydro-8H-pyrano[3'',4'':5',6']pyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-4-yl)imino]diethanol

Catalog ID
STK684625
SMILES OCCN(c1nnnc2c1sc1c2cc2c(n1)CC(OC2)(C)C)CCO

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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 C17H21N5O3S MW 375.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N5O3S/c1-17(2)8-12-10(9-25-17)7-11-13-14(26-16(11)18-12)15(20-21-19-13)22(3-5-23)4-6-24/h7,23-24H,3-6,8-9H2,1-2H3
InChIKey
XRZAQXZJMCTFFX-UHFFFAOYSA-N
Synonyms

22((88dimethyl710dihydro8Hpyrano(3456)pyrido(3245)thieno(32d)(123)triazin4yl)imino)diethanol
CC1(CC2=C(CO1)C=C3C4=C(C(=NN=N4)N(CCO)CCO)SC3=N2)C
InChI=1SC17H21N5O3Sc117(2)81210(92517)7111314(2616(11)1812)15(20211913)22(3523)4624h72324H3689H212H3
MFCD05855513
ZINC000004694736
ZINC04694736
ZINC4694736

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Available files

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