Vitas-M small molecule compound
(5Z)-2-[(E)-2-(4-chlorophenyl)ethenyl]-5-[3-methoxy-4-(3-methylbutoxy)benzylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK799839
SMILES COc1cc(ccc1OCCC(C)C)/C=c/1\sc2n(c1=O)nc(n2)/C=C/c1ccc(cc1)Cl
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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 C25H24ClN3O3S MW 482.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN3O3S/c1-16(2)12-13-32-20-10-6-18(14-21(20)31-3)15-22-24(30)29-25(33-22)27-23(28-29)11-7-17-4-8-19(26)9-5-17/h4-11,14-16H,12-13H2,1-3H3/b11-7+,22-15-InChIKey
SGNNPNMYVZEKGF-SVLWCXSNSA-NSynonyms
(5Z)2((E)2(4chlorophenyl)ethenyl)5((3methoxy4(3methylbutoxy)phenyl)methylidene)(13)thiazolo(32b)(124)triazol6one
(5Z)2((E)2(4chlorophenyl)ethenyl)5(3methoxy4(3methylbutoxy)benzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
CC(C)CCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C=CC4=CC=C(C=C4)Cl)S2)OC
COc1cc(ccc1OCCC(C)C)C=c1sc2n(c1=O)nc(n2)C=Cc1ccc(cc1)Cl
InChI=1SC25H24ClN3O3Sc116(2)1213322010618(1421(20)313)152224(30)2925(3322)2723(2829)117174819(26)9517h4111416H1213H213H3b117+2215
MFCD06642814
ZINC000016735186
ZINC16735186
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