Vitas-M small molecule compound

2-(benzylsulfanyl)-N-[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]-1,3-benzothiazol-6-amine

Catalog ID
STK011523
SMILES O1CCN(CC1)c1nc(Nc2ccc3c(c2)sc(n3)SCc2ccccc2)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 C25H27N7O2S2 MW 521.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N7O2S2/c1-2-4-18(5-3-1)17-35-25-27-20-7-6-19(16-21(20)36-25)26-22-28-23(31-8-12-33-13-9-31)30-24(29-22)32-10-14-34-15-11-32/h1-7,16H,8-15,17H2,(H,26,28,29,30)
InChIKey
YSPOXTPGXKNUFA-UHFFFAOYSA-N
Synonyms
531542-36-6
2(BENZYLSULFANYL)N(46DI(MORPHOLIN4YL)135TRIAZIN2YL)13BENZOTHIAZOL6AMINE
2(benzylthio)N(46dimorpholino135triazin2yl)benzo(d)thiazol6amine
2BENZYLSULFANYLN(46DIMORPHOLIN4YL135TRIAZIN2YL)13BENZOTHIAZOL6AMINE
531542366
C1COCCN1C2=NC(=NC(=N2)NC3=CC4=C(C=C3)N=C(S4)SCC5=CC=CC=C5)N6CCOCC6
InChI=1SC25H27N7O2S2c12418(531)17352527207619(1621(20)3625)26222823(318123313931)3024(2922)32101434151132h1716H81517H2(H26282930)
MFCD03355680
N(2(BENZYLTHIO)BENZOTHIAZOLE6YL)46DIMORPHOLINOSTRIAZINE2AMINE
O1CCN(CC1)c1nc(Nc2ccc3c(c2)sc(n3)SCc2ccccc2)nc(n1)N1CCOCC1
STK011523
ZINC000002233288
ZINC02233288
ZINC2233288

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Available files

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