Vitas-M small molecule compound

1-(4-bromophenyl)-2-[(6-{[4,6-di(morpholin-4-yl)-1,3,5-triazin-2-yl]amino}-1,3-benzothiazol-2-yl)sulfanyl]ethanone

Catalog ID
STK120862
SMILES Brc1ccc(cc1)C(=O)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 C26H26BrN7O3S2 MW 628.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26BrN7O3S2/c27-18-3-1-17(2-4-18)21(35)16-38-26-29-20-6-5-19(15-22(20)39-26)28-23-30-24(33-7-11-36-12-8-33)32-25(31-23)34-9-13-37-14-10-34/h1-6,15H,7-14,16H2,(H,28,30,31,32)
InChIKey
QMTZZRNHMZREDU-UHFFFAOYSA-N
Synonyms

1(4BROMOPHENYL)2((6((46DI(MORPHOLIN4YL)135TRIAZIN2YL)AMINO)13BENZOTHIAZOL2YL)SULFANYL)ETHANONE
1(4BROMOPHENYL)2((6((46DIMORPHOLIN4YL135TRIAZIN2YL)AMINO)13BENZOTHIAZOL2YL)SULFANYL)ETHANONE
2(6((46DIMORPHOLIN4YL(135TRIAZIN2YL))AMINO)BENZOTHIAZOL2YLTHIO)1(4BROMOPHENYL)ETHAN1ONE
C1COCCN1C2=NC(=NC(=N2)NC3=CC4=C(C=C3)N=C(S4)SCC(=O)C5=CC=C(C=C5)Br)N6CCOCC6
InChI=1SC26H26BrN7O3S2c27183117(2418)21(35)16382629206519(1522(20)3926)28233024(337113612833)3225(3123)3491337141034h1615H71416H2(H28303132)
MFCD03355689
ZINC000097995714
ZINC97995714

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Available files

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