Vitas-M small molecule compound
(5Z)-5-{[3-(3-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-phenyl[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK703059
SMILES CCCOc1ccc(cc1C)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)c1ccccc1)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 C30H25N5O2S MW 519.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N5O2S/c1-3-16-37-25-15-14-22(17-20(25)2)27-23(19-34(32-27)24-12-8-5-9-13-24)18-26-29(36)35-30(38-26)31-28(33-35)21-10-6-4-7-11-21/h4-15,17-19H,3,16H2,1-2H3/b26-18-InChIKey
MQTRKAGQUMANKI-ITYLOYPMSA-NSynonyms
(5Z)5((3(3methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2phenyl(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((3(3METHYL4PROPOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2PHENYL(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(Z)5((3(3methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylene)2phenylthiazolo(32b)(124)triazol6(5H)one
CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5=CC=CC=C5)S3)C6=CC=CC=C6)C
CCCOc1ccc(cc1C)c1nn(cc1C=c1sc2n(c1=O)nc(n2)c1ccccc1)c1ccccc1
InChI=1SC30H25N5O2Sc13163725151422(1720(25)2)2723(1934(3227)24128591324)182629(36)3530(3826)3128(3335)21106471121h4151719H316H212H3b2618
MFCD02987099
ZINC000001813381
ZINC01813381
ZINC1813381
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