Vitas-M small molecule compound
(5E)-5-{[5-(4-chlorophenyl)furan-2-yl]methylidene}-2-(2,3-dihydro-1,4-benzodioxin-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK704546
SMILES Clc1ccc(cc1)c1ccc(o1)/C=c\1/sc2n(c1=O)nc(n2)C1COc2c(O1)cccc2
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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 C23H14ClN3O4S MW 463.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H14ClN3O4S/c24-14-7-5-13(6-8-14)16-10-9-15(30-16)11-20-22(28)27-23(32-20)25-21(26-27)19-12-29-17-3-1-2-4-18(17)31-19/h1-11,19H,12H2/b20-11+InChIKey
OHJKGQDGASRKDQ-RGVLZGJSSA-NSynonyms
(5E)5((5(4chlorophenyl)furan2yl)methylidene)2(23dihydro14benzodioxin2yl)(13)thiazolo(32b)(124)triazol6(5H)one
(5E)5((5(4chlorophenyl)furan2yl)methylidene)2(23dihydro14benzodioxin3yl)(13)thiazolo(32b)(124)triazol6one
C1C(OC2=CC=CC=C2O1)C3=NN4C(=O)C(=CC5=CC=C(O5)C6=CC=C(C=C6)Cl)SC4=N3
Clc1ccc(cc1)c1ccc(o1)C=c1sc2n(c1=O)nc(n2)C1COc2c(O1)cccc2
InChI=1SC23H14ClN3O4Sc24147513(6814)1610915(3016)112022(28)2723(3220)2521(2627)19122917312418(17)3119h11119H12H2b2011+
MFCD04531554
ZINC000016734336
ZINC000016734339
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