Vitas-M small molecule compound
(5Z)-5-{[3-(4-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(4-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK703044
SMILES CCCCOc1ccc(cc1)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1ccc(cc1)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 C31H27N5O2S MW 533.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N5O2S/c1-3-4-18-38-26-16-14-22(15-17-26)28-24(20-35(33-28)25-8-6-5-7-9-25)19-27-30(37)36-31(39-27)32-29(34-36)23-12-10-21(2)11-13-23/h5-17,19-20H,3-4,18H2,1-2H3/b27-19-InChIKey
IMTRJTLNHUAIQP-DIBXZPPDSA-NSynonyms
(5Z)5((3(4butoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2(4methylphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((3(4BUTOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2(4METHYLPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)5((3(4butoxyphenyl)1phenyl1Hpyrazol4yl)methylene)2(ptolyl)thiazolo(32b)(124)triazol6(5H)one
CCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=C(C=C5)C)S3)C6=CC=CC=C6
CCCCOc1ccc(cc1)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)C)c1ccccc1
InChI=1SC31H27N5O2Sc134183826161422(151726)2824(2035(3328)258657925)192730(37)3631(3927)3229(3436)23121021(2)111323h5171920H3418H212H3b2719
MFCD02988739
ZINC000100766832
ZINC100766832
Check stock
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Check stock on Vitas-MAvailable files
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