Vitas-M small molecule compound

N-(1,3-benzothiazol-2-yl)-2-{[4-(morpholin-4-yl)-6-(phenylamino)-1,3,5-triazin-2-yl]sulfanyl}acetamide

Catalog ID
STK291695
SMILES O=C(Nc1nc2c(s1)cccc2)CSc1nc(Nc2ccccc2)nc(n1)N1CCOCC1

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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 C22H21N7O2S2 MW 479.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N7O2S2/c30-18(25-22-24-16-8-4-5-9-17(16)33-22)14-32-21-27-19(23-15-6-2-1-3-7-15)26-20(28-21)29-10-12-31-13-11-29/h1-9H,10-14H2,(H,24,25,30)(H,23,26,27,28)
InChIKey
KTQWQKUHIMANLS-UHFFFAOYSA-N
Synonyms
875007-20-8
875007208
C1COCCN1C2=NC(=NC(=N2)SCC(=O)NC3=NC4=CC=CC=C4S3)NC5=CC=CC=C5
InChI=1SC22H21N7O2S2c3018(25222416845917(16)3322)1432212719(23156213715)2620(2821)29101231131129h19H1014H2(H242530)(H23262728)
MFCD07178811
N(13benzothiazol2yl)2((4(morpholin4yl)6(phenylamino)135triazin2yl)sulfanyl)acetamide
N(benzo(d)thiazol2yl)2((4morpholino6(phenylamino)135triazin2yl)thio)acetamide

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Available files

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