Vitas-M small molecule compound
(10Z)-10-[(1-butyl-1H-indol-3-yl)methylidene]-7-(2-chlorophenyl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK322873
SMILES CCCCn1cc(c2c1cccc2)/C=c/1\sc2=NC3=C(C(n2c1=O)c1ccccc1Cl)CCc1c3cccc1
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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 C33H28ClN3OS MW 550.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H28ClN3OS/c1-2-3-18-36-20-22(23-11-7-9-15-28(23)36)19-29-32(38)37-31(25-13-6-8-14-27(25)34)26-17-16-21-10-4-5-12-24(21)30(26)35-33(37)39-29/h4-15,19-20,31H,2-3,16-18H2,1H3/b29-19-InChIKey
JWSPLLRRTZPEBA-CEUNXORHSA-NSynonyms
(10Z)10((1butyl1Hindol3yl)methylidene)7(2chlorophenyl)57dihydro6Hbenzo(h)(13)thiazolo(23b)quinazolin9(10H)one
CCCCN1C=C(C2=CC=CC=C21)C=C3C(=O)N4C(C5=C(C6=CC=CC=C6CC5)N=C4S3)C7=CC=CC=C7Cl
CCCCn1cc(c2c1cccc2)C=c1sc2=NC3=C(C(n2c1=O)c1ccccc1Cl)CCc1c3cccc1
InChI=1SC33H28ClN3OSc12318362022(2311791528(23)36)192932(38)3731(2513681427(25)34)2617162110451224(21)30(26)3533(37)3929h415192031H231618H21H3b2919
MFCD09961633
ZINC000097962506
ZINC000097962507
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