Vitas-M small molecule compound

(5Z)-5-{[3-(3-butoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-(2,6-dimethylmorpholin-4-yl)-1,3-thiazol-4(5H)-one

Catalog ID
STK707026
SMILES CCCCOc1cccc(c1)c1nn(cc1/C=C/1\SC(=NC1=O)N1CC(C)OC(C1)C)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 C29H32N4O3S MW 516.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H32N4O3S/c1-4-5-14-35-25-13-9-10-22(15-25)27-23(19-33(31-27)24-11-7-6-8-12-24)16-26-28(34)30-29(37-26)32-17-20(2)36-21(3)18-32/h6-13,15-16,19-21H,4-5,14,17-18H2,1-3H3/b26-16-
InChIKey
HXIUMCUWPDZGOG-QQXSKIMKSA-N
Synonyms
1009438-82-7
(5Z)5((3(3butoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)2(26dimethylmorpholin4yl)13thiazol4(5H)one
(5Z)5((3(3BUTOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2(26DIMETHYLMORPHOLIN4YL)13THIAZOL4ONE
(Z)5((3(3butoxyphenyl)1phenyl1Hpyrazol4yl)methylene)2(26dimethylmorpholino)thiazol4(5H)one
1009438827
CCCCOC1=CC=CC(=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N4CC(OC(C4)C)C)C5=CC=CC=C5
CCCCOc1cccc(c1)c1nn(cc1C=C1SC(=NC1=O)N1CC(C)OC(C1)C)c1ccccc1
InChI=1SC29H32N4O3Sc1451435251391022(1525)2723(1933(3127)24117681224)162628(34)3029(3726)321720(2)3621(3)1832h61315161921H45141718H213H3b2616
MFCD04032462
ZINC000002395884
ZINC000009191084

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Available files

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