Vitas-M small molecule compound
ethyl {(4E)-4-[(5Z)-3-benzyl-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
STK368311
SMILES CCOC(=O)CC1=NN(C(=O)/C/1=c\1/s/c(=c/2\sc3c(n2C)cc(cc3)OC)/c(=O)n1Cc1ccccc1)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 C32H28N4O5S2 MW 612.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28N4O5S2/c1-4-41-26(37)18-23-27(29(38)36(33-23)21-13-9-6-10-14-21)31-35(19-20-11-7-5-8-12-20)30(39)28(43-31)32-34(2)24-17-22(40-3)15-16-25(24)42-32/h5-17H,4,18-19H2,1-3H3/b31-27+,32-28-InChIKey
IGMIMYRVAAHSLB-DEDSWAOCSA-NSynonyms
CCOC(=O)CC1=NN(C(=O)C1=c1sc(=c2sc3c(n2C)cc(cc3)OC)c(=O)n1Cc1ccccc1)c1ccccc1
CCOC(=O)CC1=NN(C(=O)C1=C2N(C(=O)C(=C3N(C4=C(S3)C=CC(=C4)OC)C)S2)CC5=CC=CC=C5)C6=CC=CC=C6
ethyl((4E)4((5Z)3benzyl5(5methoxy3methyl13benzothiazol2(3H)ylidene)4oxo13thiazolidin2ylidene)5oxo1phenyl45dihydro1Hpyrazol3yl)acetate
ETHYL2((4E)4((5Z)3BENZYL5(5METHOXY3METHYL13BENZOTHIAZOL2YLIDENE)4OXO13THIAZOLIDIN2YLIDENE)5OXO1PHENYLPYRAZOL3YL)ACETATE
ETHYL2(4(5(5METHOXY3METHYL(3HYDROBENZOTHIAZOL2YLIDENE))4OXO3BENZYL(13THIAZOLIDIN2YLIDENE))5OXO1PHENYL12DIAZOLIN3YL)ACETATE
InChI=1SC32H28N4O5S2c144126(37)182327(29(38)36(3323)211396101421)3135(1920117581220)30(39)28(4331)3234(2)241722(403)151625(24)4232h517H41819H213H3b3127+3228
MFCD03648625
ZINC000004016520
ZINC4016520
Check stock
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