Vitas-M small molecule compound
(10E)-10-(3-ethoxy-4-hydroxy-5-iodobenzylidene)-7-(thiophen-2-yl)-5,7-dihydro-6H-benzo[h][1,3]thiazolo[2,3-b]quinazolin-9(10H)-one
Catalog ID
STK073223
SMILES CCOc1cc(cc(c1O)I)/C=c\1/sc2=NC3=C(C(n2c1=O)c1cccs1)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 C27H21IN2O3S2 MW 612.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21IN2O3S2/c1-2-33-20-13-15(12-19(28)25(20)31)14-22-26(32)30-24(21-8-5-11-34-21)18-10-9-16-6-3-4-7-17(16)23(18)29-27(30)35-22/h3-8,11-14,24,31H,2,9-10H2,1H3/b22-14+InChIKey
TZWHFKKEPFESLL-HYARGMPZSA-NSynonyms
(10E)10(3ETHOXY4HYDROXY5IODOBENZYLIDENE)7(THIOPHEN2YL)57DIHYDRO6HBENZO(H)(13)THIAZOLO(23B)QUINAZOLIN9(10H)ONE
(Z)10(3ethoxy4hydroxy5iodobenzylidene)7(thiophen2yl)710dihydro5Hbenzo(h)thiazolo(23b)quinazolin9(6H)one
CCOC1=C(C(=CC(=C1)C=C2C(=O)N3C(C4=C(C5=CC=CC=C5CC4)N=C3S2)C6=CC=CS6)I)O
CCOc1cc(cc(c1O)I)C=c1sc2=NC3=C(C(n2c1=O)c1cccs1)CCc1c3cccc1
InChI=1SC27H21IN2O3S2c1233201315(1219(28)25(20)31)142226(32)3024(2185113421)1810916634717(16)23(18)2927(30)3522h3811142431H2910H21H3b2214+
MFCD02799300
STK073223
ZINC000100958423
ZINC000100958425
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