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ethyl {(4E)-4-[(5Z)-3-benzyl-5-(5-chloro-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
STK383551
SMILES CCOC(=O)CC1=NN(C(=O)/C/1=c\1/s/c(=c/2\sc3c(n2C)cc(cc3)Cl)/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 C31H25ClN4O4S2 MW 617.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25ClN4O4S2/c1-3-40-25(37)17-22-26(28(38)36(33-22)21-12-8-5-9-13-21)30-35(18-19-10-6-4-7-11-19)29(39)27(42-30)31-34(2)23-16-20(32)14-15-24(23)41-31/h4-16H,3,17-18H2,1-2H3/b30-26+,31-27-
InChIKey
CTNGUGAURMSAIE-FDMCKTFZSA-N
Synonyms

CCOC(=O)CC1=NN(C(=O)C1=c1sc(=c2sc3c(n2C)cc(cc3)Cl)c(=O)n1Cc1ccccc1)c1ccccc1
CCOC(=O)CC1=NN(C(=O)C1=C2N(C(=O)C(=C3N(C4=C(S3)C=CC(=C4)Cl)C)S2)CC5=CC=CC=C5)C6=CC=CC=C6
ethyl((4E)4((5Z)3benzyl5(5chloro3methyl13benzothiazol2(3H)ylidene)4oxo13thiazolidin2ylidene)5oxo1phenyl45dihydro1Hpyrazol3yl)acetate
ETHYL(4(3BENZYL5(5CHLORO3METHYL13BENZOTHIAZOL2(3H)YLIDENE)4OXO13THIAZOLIDIN2YLIDENE)5OXO1PHENYL45DIHYDRO1HPYRAZOL3YL)ACETATE
ETHYL2((4E)4((5Z)3BENZYL5(5CHLORO3METHYL13BENZOTHIAZOL2YLIDENE)4OXO13THIAZOLIDIN2YLIDENE)5OXO1PHENYLPYRAZOL3YL)ACETATE
ETHYL2(4(5(5CHLORO3METHYL(3HYDROBENZOTHIAZOL2YLIDENE))4OXO3BENZYL(13THIAZOLIDIN2YLIDENE))5OXO1PHENYL12DIAZOLIN3YL)ACETATE
InChI=1SC31H25ClN4O4S2c134025(37)172226(28(38)36(3322)21128591321)3035(1819106471119)29(39)27(4230)3134(2)231620(32)141524(23)4131h416H31718H212H3b3026+3127
MFCD01077981
ZINC000102154633
ZINC102154633

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Available files

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