Vitas-M small molecule compound
(5Z)-2-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-5-({3-[3-methyl-4-(2-methylpropoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK516589
SMILES COc1cc(/C=C/c2nn3c(n2)s/c(=C\c2cn(nc2c2ccc(c(c2)C)OCC(C)C)c2ccccc2)/c3=O)ccc1OC
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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 C35H33N5O4S MW 619.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H33N5O4S/c1-22(2)21-44-28-15-13-25(17-23(28)3)33-26(20-39(38-33)27-9-7-6-8-10-27)19-31-34(41)40-35(45-31)36-32(37-40)16-12-24-11-14-29(42-4)30(18-24)43-5/h6-20,22H,21H2,1-5H3/b16-12+,31-19-InChIKey
RSCFEXDURWXKHJ-QMRBYUSESA-NSynonyms
(5Z)2((E)2(34dimethoxyphenyl)ethenyl)5((3(3methyl4(2methylpropoxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)2((E)2(34dimethoxyphenyl)ethenyl)5((3(3methyl4(2methylpropoxy)phenyl)1phenylpyrazol4yl)methylidene)(13)thiazolo(32b)(124)triazol6one
CC1=C(C=CC(=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C=CC5=CC(=C(C=C5)OC)OC)S3)C6=CC=CC=C6)OCC(C)C
COc1cc(C=Cc2nn3c(n2)sc(=Cc2cn(nc2c2ccc(c(c2)C)OCC(C)C)c2ccccc2)c3=O)ccc1OC
InChI=1SC35H33N5O4Sc122(2)214428151325(1723(28)3)3326(2039(3833)2797681027)193134(41)4035(4531)3632(3740)161224111429(424)30(1824)435h62022H21H215H3b1612+3119
MFCD06645742
ZINC000097946795
ZINC97946795
Check stock
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