Vitas-M small molecule compound
(5Z)-5-({1-phenyl-3-[4-(prop-2-en-1-yloxy)phenyl]-1H-pyrazol-4-yl}methylidene)-2-(thiophen-2-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK798389
SMILES C=CCOc1ccc(cc1)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1cccs1)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 C27H19N5O2S2 MW 509.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19N5O2S2/c1-2-14-34-21-12-10-18(11-13-21)24-19(17-31(29-24)20-7-4-3-5-8-20)16-23-26(33)32-27(36-23)28-25(30-32)22-9-6-15-35-22/h2-13,15-17H,1,14H2/b23-16-InChIKey
IJJUQXHHXISBQN-KQWNVCNZSA-NSynonyms
(5Z)5((1phenyl3(4(prop2en1yloxy)phenyl)1Hpyrazol4yl)methylidene)2(thiophen2yl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((1PHENYL3(4PROP2ENOXYPHENYL)PYRAZOL4YL)METHYLIDENE)2THIOPHEN2YL(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)5((3(4(allyloxy)phenyl)1phenyl1Hpyrazol4yl)methylene)2(thiophen2yl)thiazolo(32b)(124)triazol6(5H)one
C=CCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=CS5)S3)C6=CC=CC=C6
C=CCOc1ccc(cc1)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1cccs1)c1ccccc1
InChI=1SC27H19N5O2S2c12143421121018(111321)2419(1731(2924)207435820)162326(33)3227(3623)2825(3032)2296153522h2131517H114H2b2316
MFCD02990200
ZINC000013800630
ZINC13800630
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