Vitas-M small molecule compound

1-[(5Z)-5-{[3-(3-ethoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperidine-4-carboxamide

Catalog ID
STK707094
SMILES CCOc1cccc(c1)c1nn(cc1/C=C/1\SC(=NC1=O)N1CCC(CC1)C(=O)N)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 C27H27N5O3S MW 501.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O3S/c1-2-35-22-10-6-7-19(15-22)24-20(17-32(30-24)21-8-4-3-5-9-21)16-23-26(34)29-27(36-23)31-13-11-18(12-14-31)25(28)33/h3-10,15-18H,2,11-14H2,1H3,(H2,28,33)/b23-16-
InChIKey
ATQCNMHMDAQGAW-KQWNVCNZSA-N
Synonyms
1008883-35-9
(Z)1(5((3(3ethoxyphenyl)1phenyl1Hpyrazol4yl)methylene)4oxo45dihydrothiazol2yl)piperidine4carboxamide
1((5Z)5((3(3ethoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo45dihydro13thiazol2yl)piperidine4carboxamide
1((5Z)5((3(3ETHOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO13THIAZOL2YL)PIPERIDINE4CARBOXAMIDE
1008883359
CCOC1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N4CCC(CC4)C(=O)N)C5=CC=CC=C5
CCOc1cccc(c1)c1nn(cc1C=C1SC(=NC1=O)N1CCC(CC1)C(=O)N)c1ccccc1
InChI=1SC27H27N5O3Sc123522106719(1522)2420(1732(3024)218435921)162326(34)2927(3623)31131118(121431)25(28)33h3101518H21114H21H3(H22833)b2316
MFCD04019663
ZINC000013514474
ZINC13514474

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Available files

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