Vitas-M small molecule compound

N-[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]-2-{[(4-fluoronaphthalen-1-yl)methyl]sulfanyl}-1,3-benzothiazol-6-amine

Catalog ID
STK124326
SMILES Fc1ccc(c2c1cccc2)CSc1nc2c(s1)cc(cc2)Nc1nc(nc(n1)N1CCOCC1)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 C29H28FN7O2S2 MW 589.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28FN7O2S2/c30-23-7-5-19(21-3-1-2-4-22(21)23)18-40-29-32-24-8-6-20(17-25(24)41-29)31-26-33-27(36-9-13-38-14-10-36)35-28(34-26)37-11-15-39-16-12-37/h1-8,17H,9-16,18H2,(H,31,33,34,35)
InChIKey
NYRDUAVEQLJZBQ-UHFFFAOYSA-N
Synonyms

C1COCCN1C2=NC(=NC(=N2)NC3=CC4=C(C=C3)N=C(S4)SCC5=CC=C(C6=CC=CC=C56)F)N7CCOCC7
InChI=1SC29H28FN7O2S2c30237519(21312422(21)23)18402932248620(1725(24)4129)31263327(3691338141036)3528(3426)37111539161237h1817H91618H2(H31333435)
MFCD03548965
N(46DI(MORPHOLIN4YL)135TRIAZIN2YL)2(((4FLUORONAPHTHALEN1YL)METHYL)SULFANYL)13BENZOTHIAZOL6AMINE
N(46DIMORPHOLIN4YL135TRIAZIN2YL)2((4FLUORONAPHTHALEN1YL)METHYLSULFANYL)13BENZOTHIAZOL6AMINE
ZINC000097995735
ZINC97995735

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Available files

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