Vitas-M small molecule compound

(5Z)-5-({1-phenyl-3-[3-(pyrrolidin-1-ylsulfonyl)phenyl]-1H-pyrazol-4-yl}methylidene)-2-(piperidin-1-yl)-1,3-thiazol-4(5H)-one

Catalog ID
STL342930
SMILES O=C1N=C(S/C/1=C\c1cn(nc1c1cccc(c1)S(=O)(=O)N1CCCC1)c1ccccc1)N1CCCCC1

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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 C28H29N5O3S2 MW 547.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5O3S2/c34-27-25(37-28(29-27)31-14-5-2-6-15-31)19-22-20-33(23-11-3-1-4-12-23)30-26(22)21-10-9-13-24(18-21)38(35,36)32-16-7-8-17-32/h1,3-4,9-13,18-20H,2,5-8,14-17H2/b25-19-
InChIKey
ZXIFTSOUBHTMSJ-PLRJNAJWSA-N
Synonyms
1001784-74-2
(5Z)5((1phenyl3(3(pyrrolidin1ylsulfonyl)phenyl)1Hpyrazol4yl)methylidene)2(piperidin1yl)13thiazol4(5H)one
(5Z)5((1PHENYL3(3PYRROLIDIN1YLSULFONYLPHENYL)PYRAZOL4YL)METHYLIDENE)2PIPERIDIN1YL13THIAZOL4ONE
(Z)5((1phenyl3(3(pyrrolidin1ylsulfonyl)phenyl)1Hpyrazol4yl)methylene)2(piperidin1yl)thiazol4(5H)one
1001784742
C1CCN(CC1)C2=NC(=O)C(=CC3=CN(N=C3C4=CC(=CC=C4)S(=O)(=O)N5CCCC5)C6=CC=CC=C6)S2
InChI=1SC28H29N5O3S2c342725(3728(2927)31145261531)19222033(23113141223)3026(22)211091324(1821)38(3536)3216781732h1349131820H2581417H2b2519
MFCD04160145
O=C1N=C(SC1=Cc1cn(nc1c1cccc(c1)S(=O)(=O)N1CCCC1)c1ccccc1)N1CCCCC1
ZINC000002405286
ZINC2405286

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Available files

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