Vitas-M small molecule compound

(10E)-10-[2-(benzyloxy)-3,5-diiodobenzylidene]-7-(4-fluorophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one

Catalog ID
STK326070
SMILES Fc1ccc(cc1)C1C2=C(N=c3n1c(=O)/c(=C\c1cc(I)cc(c1OCc1ccccc1)I)/s3)c1c(CC2)cccc1

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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 C34H23FI2N2O2S MW 796.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H23FI2N2O2S/c35-24-13-10-22(11-14-24)31-27-15-12-21-8-4-5-9-26(21)30(27)38-34-39(31)33(40)29(42-34)17-23-16-25(36)18-28(37)32(23)41-19-20-6-2-1-3-7-20/h1-11,13-14,16-18,31H,12,15,19H2/b29-17+
InChIKey
KGVDWCSYAJDUFC-STBIYBPSSA-N
Synonyms

(10E)10(2(benzyloxy)35diiodobenzylidene)7(4fluorophenyl)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
(E)10(2(benzyloxy)35diiodobenzylidene)7(4fluorophenyl)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
C1CC2=C(C3=CC=CC=C31)N=C4N(C2C5=CC=C(C=C5)F)C(=O)C(=CC6=CC(=CC(=C6OCC7=CC=CC=C7)I)I)S4
Fc1ccc(cc1)C1C2=C(N=c3n1c(=O)c(=Cc1cc(I)cc(c1OCc1ccccc1)I)s3)c1c(CC2)cccc1
InChI=1SC34H23FI2N2O2Sc3524131022(111424)3127151221845926(21)30(27)383439(31)33(40)29(4234)17231625(36)1828(37)32(23)4119206213720h1111314161831H121519H2b2917+
MFCD03667307
ZINC000097962574
ZINC000097962575

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Available files

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