Vitas-M small molecule compound
(5Z)-5-({3-[4-(benzyloxy)-3-methylphenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-(4-butoxyphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK816588
SMILES CCCCOc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C/c1cn(nc1c1ccc(c(c1)C)OCc1ccccc1)c1ccccc1)/s2
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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 C38H33N5O3S MW 639.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H33N5O3S/c1-3-4-21-45-32-18-15-28(16-19-32)36-39-38-43(41-36)37(44)34(47-38)23-30-24-42(31-13-9-6-10-14-31)40-35(30)29-17-20-33(26(2)22-29)46-25-27-11-7-5-8-12-27/h5-20,22-24H,3-4,21,25H2,1-2H3/b34-23-InChIKey
QZICKIJUJFZASH-XSVYLIDLSA-NSynonyms
(5Z)2(4BUTOXYPHENYL)5((3(3METHYL4PHENYLMETHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5((3(4(benzyloxy)3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)2(4butoxyphenyl)(13)thiazolo(32b)(124)triazol6(5H)one
CCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC(=C(C=C5)OCC6=CC=CC=C6)C)C7=CC=CC=C7)SC3=N2
CCCCOc1ccc(cc1)c1nc2n(n1)c(=O)c(=Cc1cn(nc1c1ccc(c(c1)C)OCc1ccccc1)c1ccccc1)s2
InChI=1SC38H33N5O3Sc134214532181528(161932)36393843(4136)37(44)34(4738)23302442(311396101431)4035(30)29172033(26(2)2229)462527117581227h5202224H342125H212H3b3423
MFCD03534806
ZINC000097946656
ZINC97946656
Check stock
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