Vitas-M small molecule compound
(2E,5Z)-2-{3-[(3-bromophenyl)amino]-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene}-5-(5-chloro-3-methyl-1,3-benzothiazol-2(3H)-ylidene)-3-ethyl-1,3-thiazolidin-4-one
Catalog ID
STK383566
SMILES CCn1/c(=C\2/C(=NN(C2=O)c2ccccc2)Nc2cccc(c2)Br)/s/c(=c/2\sc3c(n2C)cc(cc3)Cl)/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 C28H21BrClN5O2S2 MW 639.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21BrClN5O2S2/c1-3-34-26(37)23(28-33(2)20-15-17(30)12-13-21(20)38-28)39-27(34)22-24(31-18-9-7-8-16(29)14-18)32-35(25(22)36)19-10-5-4-6-11-19/h4-15H,3H2,1-2H3,(H,31,32)/b27-22+,28-23-InChIKey
FPPWENWMBHMLBE-YJZCZVOBSA-NSynonyms
(2E5Z)2(3((3bromophenyl)amino)5oxo1phenyl15dihydro4Hpyrazol4ylidene)5(5chloro3methyl13benzothiazol2(3H)ylidene)3ethyl13thiazolidin4one
(2E5Z)2(3(3BROMOANILINO)5OXO1PHENYLPYRAZOL4YLIDENE)5(5CHLORO3METHYL13BENZOTHIAZOL2YLIDENE)3ETHYL13THIAZOLIDIN4ONE
2(3((3BROMOPHENYL)AMINO)5OXO1PHENYL(12DIAZOLIN4YLIDENE))5(5CHLORO3METHYL(3HYDROBENZOTHIAZOL2YLIDENE))3ETHYL13THIAZOLIDIN4ONE
CCn1c(=C2C(=NN(C2=O)c2ccccc2)Nc2cccc(c2)Br)sc(=c2sc3c(n2C)cc(cc3)Cl)c1=O
CCN1C(=C2C(=NN(C2=O)C3=CC=CC=C3)NC4=CC(=CC=C4)Br)SC(=C5N(C6=C(S5)C=CC(=C6)Cl)C)C1=O
InChI=1SC28H21BrClN5O2S2c133426(37)23(2833(2)201517(30)121321(20)3828)3927(34)2224(311897816(29)1418)3235(25(22)36)19105461119h415H3H212H3(H3132)b2722+2823
MFCD03648727
ZINC000097964014
ZINC97964014
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