Vitas-M small molecule compound
(5Z)-5-{[3-(4-butoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(4-tert-butylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK702407
SMILES CCCCOc1ccc(cc1C)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1ccc(cc1)C(C)(C)C)c1ccccc1
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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 C35H35N5O2S MW 589.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H35N5O2S/c1-6-7-19-42-29-18-15-25(20-23(29)2)31-26(22-39(37-31)28-11-9-8-10-12-28)21-30-33(41)40-34(43-30)36-32(38-40)24-13-16-27(17-14-24)35(3,4)5/h8-18,20-22H,6-7,19H2,1-5H3/b30-21-InChIKey
LAFMJYZNNAEOBR-OFWBYEQRSA-NSynonyms
(5Z)5((3(4butoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)2(4tertbutylphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((3(4BUTOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2(4TERTBUTYLPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)5((3(4butoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylene)2(4(tertbutyl)phenyl)thiazolo(32b)(124)triazol6(5H)one
CCCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=C(C=C5)C(C)(C)C)S3)C6=CC=CC=C6)C
CCCCOc1ccc(cc1C)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)C(C)(C)C)c1ccccc1
InChI=1SC35H35N5O2Sc167194229181525(2023(29)2)3126(2239(3731)281198101228)213033(41)4034(4330)3632(3840)24131627(171424)35(34)5h8182022H6719H215H3b3021
MFCD02990813
ZINC000097946361
ZINC97946361
Check stock
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