Vitas-M small molecule compound
(5Z)-5-{[3-(4-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-[(E)-2-phenylethenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK904699
SMILES CCOc1ccc(cc1)c1nn(cc1/C=c/1\sc2n(c1=O)nc(n2)/C=C/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 C30H23N5O2S MW 517.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H23N5O2S/c1-2-37-25-16-14-22(15-17-25)28-23(20-34(33-28)24-11-7-4-8-12-24)19-26-29(36)35-30(38-26)31-27(32-35)18-13-21-9-5-3-6-10-21/h3-20H,2H2,1H3/b18-13+,26-19-InChIKey
JVWDAFLEHLIAQB-CZISYXTLSA-NSynonyms
(5Z)5((3(4ethoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2((E)2phenylethenyl)(13)thiazolo(32b)(124)triazol6(5H)one
(5Z)5((3(4ethoxyphenyl)1phenylpyrazol4yl)methylidene)2((E)2phenylethenyl)(13)thiazolo(32b)(124)triazol6one
CCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C=CC5=CC=CC=C5)S3)C6=CC=CC=C6
CCOc1ccc(cc1)c1nn(cc1C=c1sc2n(c1=O)nc(n2)C=Cc1ccccc1)c1ccccc1
InChI=1SC30H23N5O2Sc123725161422(151725)2823(2034(3328)24117481224)192629(36)3530(3826)3127(3235)18132195361021h320H2H21H3b1813+2619
MFCD07480787
ZINC000027022450
ZINC27022450
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