Vitas-M small molecule compound
ethyl {(4E)-4-[(5Z)-3-butyl-5-(5-methoxy-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-4-oxo-1,3-thiazolidin-2-ylidene]-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl}acetate
Catalog ID
STK368230
SMILES CCCCn1/c(=C\2/C(=NN(C2=O)c2ccccc2)CC(=O)OCC)/s/c(=c/2\sc3c(n2C)cc(cc3)OC)/c1=O
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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 C29H30N4O5S2 MW 578.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N4O5S2/c1-5-7-15-32-27(36)25(29-31(3)21-16-19(37-4)13-14-22(21)39-29)40-28(32)24-20(17-23(34)38-6-2)30-33(26(24)35)18-11-9-8-10-12-18/h8-14,16H,5-7,15,17H2,1-4H3/b28-24+,29-25-InChIKey
HZHLMJCKIBAIRZ-CIMIHRMLSA-NSynonyms
CCCCn1c(=C2C(=NN(C2=O)c2ccccc2)CC(=O)OCC)sc(=c2sc3c(n2C)cc(cc3)OC)c1=O
CCCCN1C(=C2C(=NN(C2=O)C3=CC=CC=C3)CC(=O)OCC)SC(=C4N(C5=C(S4)C=CC(=C5)OC)C)C1=O
ethyl((4E)4((5Z)3butyl5(5methoxy3methyl13benzothiazol2(3H)ylidene)4oxo13thiazolidin2ylidene)5oxo1phenyl45dihydro1Hpyrazol3yl)acetate
ETHYL2((4E)4((5Z)3BUTYL5(5METHOXY3METHYL13BENZOTHIAZOL2YLIDENE)4OXO13THIAZOLIDIN2YLIDENE)5OXO1PHENYLPYRAZOL3YL)ACETATE
ETHYL2(4(3BUTYL5(5METHOXY3METHYL(3HYDROBENZOTHIAZOL2YLIDENE))4OXO(13THIAZOLIDIN2YLIDENE))5OXO1PHENYL12DIAZOLIN3YL)ACETATE
InChI=1SC29H30N4O5S2c157153227(36)25(2931(3)211619(374)131422(21)3929)4028(32)2420(1723(34)3862)3033(26(24)35)181198101218h81416H571517H214H3b2824+2925
MFCD00625263
ZINC000097990151
ZINC97990151
Check stock
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Check stock on Vitas-MAvailable files
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