Vitas-M small molecule compound

(9E)-9-(2-chlorobenzylidene)-5-(2-chlorophenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-6,7,8,9-tetrahydro-5H-[1,3]thiazolo[2,3-b]quinazoline

Catalog ID
STK534943
SMILES Clc1ccccc1C1C2=C(N=c3n1c(cs3)c1ccc3c(c1)OCCO3)/C(=C/c1ccccc1Cl)/CCC2

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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 C31H24Cl2N2O2S MW 559.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H24Cl2N2O2S/c32-24-10-3-1-6-19(24)16-21-7-5-9-23-29(21)34-31-35(30(23)22-8-2-4-11-25(22)33)26(18-38-31)20-12-13-27-28(17-20)37-15-14-36-27/h1-4,6,8,10-13,16-18,30H,5,7,9,14-15H2/b21-16+
InChIKey
PABSUVDHAVBWEV-LTGZKZEYSA-N
Synonyms

(9E)5(2chlorophenyl)9((2chlorophenyl)methylidene)3(23dihydro14benzodioxin6yl)5678tetrahydro(13)thiazolo(23b)quinazoline
(9E)9(2chlorobenzylidene)5(2chlorophenyl)3(23dihydro14benzodioxin6yl)6789tetrahydro5H(13)thiazolo(23b)quinazoline
(E)9(2chlorobenzylidene)5(2chlorophenyl)3(23dihydrobenzo(b)(14)dioxin6yl)6789tetrahydro5Hthiazolo(23b)quinazolinehydrobromide
C1CC(=CC2=CC=CC=C2Cl)C3=C(C1)C(N4C(=CSC4=N3)C5=CC6=C(C=C5)OCCO6)C7=CC=CC=C7Cl
Clc1ccccc1C1C2=C(N=c3n1c(cs3)c1ccc3c(c1)OCCO3)C(=Cc1ccccc1Cl)CCC2
Clc1ccccc1C1C2=C(N=c3n1c(cs3)c1ccc3c(c1)OCCO3)C(=Cc1ccccc1Cl)CCC2Br
InChI=1SC31H24Cl2N2O2Sc32241031619(24)16217592329(21)343135(30(23)228241125(22)33)26(183831)2012132728(1720)3715143627h14681013161830H5791415H2b2116+
MFCD02988799
ZINC000102612086
ZINC000102612089

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Available files

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