Vitas-M small molecule compound
(3Z)-3-{2-[4-(hexyloxy)phenyl]-6-oxo[1,3]thiazolo[3,2-b][1,2,4]triazol-5(6H)-ylidene}-1-methyl-1,3-dihydro-2H-indol-2-one
Catalog ID
STK818508
SMILES CCCCCCOc1ccc(cc1)c1nn2c(n1)s/c(=C\1/c3ccccc3N(C1=O)C)/c2=O
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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 C25H24N4O3S MW 460.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O3S/c1-3-4-5-8-15-32-17-13-11-16(12-14-17)22-26-25-29(27-22)24(31)21(33-25)20-18-9-6-7-10-19(18)28(2)23(20)30/h6-7,9-14H,3-5,8,15H2,1-2H3/b21-20-InChIKey
TXQDEWIKOOJXBJ-MRCUWXFGSA-NSynonyms
(3Z)3(2(4(hexyloxy)phenyl)6oxo(13)thiazolo(32b)(124)triazol5(6H)ylidene)1methyl13dihydro2Hindol2one
(5Z)2(4hexoxyphenyl)5(1methyl2oxoindol3ylidene)(13)thiazolo(32b)(124)triazol6one
CCCCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=C4C5=CC=CC=C5N(C4=O)C)SC3=N2
CCCCCCOc1ccc(cc1)c1nn2c(n1)sc(=C1c3ccccc3N(C1=O)C)c2=O
InChI=1SC25H24N4O3Sc13458153217131116(121417)22262529(2722)24(31)21(3325)20189671019(18)28(2)23(20)30h67914H35815H212H3b2120
MFCD04447920
ZINC000003649540
ZINC03649540
ZINC3649540
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