Vitas-M small molecule compound
(2Z,5Z)-5-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)-3-(3-methylphenyl)-1,3-thiazolidin-4-one
Catalog ID
STK380766
SMILES Cc1cccc(c1)n1/c(=C/2\C(=NN(C2=O)c2ccccc2)C)/s/c(=c/2\sc3c(n2C)cccc3)/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 C28H22N4O2S2 MW 510.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N4O2S2/c1-17-10-9-13-20(16-17)31-26(34)24(28-30(3)21-14-7-8-15-22(21)35-28)36-27(31)23-18(2)29-32(25(23)33)19-11-5-4-6-12-19/h4-16H,1-3H3/b27-23-,28-24-InChIKey
QBHSPJDKABDOMC-JTFGNLGHSA-NSynonyms
(2Z5Z)5(3methyl13benzothiazol2(3H)ylidene)2(3methyl5oxo1phenyl15dihydro4Hpyrazol4ylidene)3(3methylphenyl)13thiazolidin4one
(2Z5Z)5(3methyl13benzothiazol2ylidene)2(3methyl5oxo1phenylpyrazol4ylidene)3(3methylphenyl)13thiazolidin4one
5(3METHYL(3HYDROBENZOTHIAZOL2YLIDENE))2(3METHYL5OXO1PHENYL(12DIAZOLIN4YLIDENE))3(3METHYLPHENYL)13THIAZOLIDIN4ONE
CC1=CC(=CC=C1)N2C(=C3C(=NN(C3=O)C4=CC=CC=C4)C)SC(=C5N(C6=CC=CC=C6S5)C)C2=O
Cc1cccc(c1)n1c(=C2C(=NN(C2=O)c2ccccc2)C)sc(=c2sc3c(n2C)cccc3)c1=O
InChI=1SC28H22N4O2S2c1171091320(1617)3126(34)24(2830(3)2114781522(21)3528)3627(31)2318(2)2932(25(23)33)19115461219h416H13H3b27232824
MFCD02187919
ZINC000100266429
ZINC100266429
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