Vitas-M small molecule compound
(2E,5Z)-3-methyl-5-(3-methyl-1,3-benzothiazol-2(3H)-ylidene)-2-[5-oxo-1-phenyl-3-(phenylamino)-1,5-dihydro-4H-pyrazol-4-ylidene]-1,3-thiazolidin-4-one
Catalog ID
STK368288
SMILES O=C1N(N=C(/C/1=c/1\s/c(=c/2\sc3c(n2C)cccc3)/c(=O)n1C)Nc1ccccc1)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 C27H21N5O2S2 MW 511.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N5O2S2/c1-30-19-15-9-10-16-20(19)35-27(30)22-25(34)31(2)26(36-22)21-23(28-17-11-5-3-6-12-17)29-32(24(21)33)18-13-7-4-8-14-18/h3-16H,1-2H3,(H,28,29)/b26-21+,27-22-InChIKey
DYHMHDFJIALSAF-MQQISXSPSA-NSynonyms
(2E5Z)2(3ANILINO5OXO1PHENYLPYRAZOL4YLIDENE)3METHYL5(3METHYL13BENZOTHIAZOL2YLIDENE)13THIAZOLIDIN4ONE
(2E5Z)3methyl5(3methyl13benzothiazol2(3H)ylidene)2(5oxo1phenyl3(phenylamino)15dihydro4Hpyrazol4ylidene)13thiazolidin4one
CN1C2=CC=CC=C2SC1=C3C(=O)N(C(=C4C(=NN(C4=O)C5=CC=CC=C5)NC6=CC=CC=C6)S3)C
InChI=1SC27H21N5O2S2c13019159101620(19)3527(30)2225(34)31(2)26(3622)2123(2817115361217)2932(24(21)33)18137481418h316H12H3(H2829)b2621+2722
MFCD03648622
O=C1N(N=C(C1=c1sc(=c2sc3c(n2C)cccc3)c(=O)n1C)Nc1ccccc1)c1ccccc1
ZINC000002054937
ZINC02054937
ZINC2054937
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