Vitas-M small molecule compound

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

Catalog ID
STK702649
SMILES CCCCOc1ccc(cc1C)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 C30H34N4O3S MW 530.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N4O3S/c1-5-6-14-36-26-13-12-23(15-20(26)2)28-24(19-34(32-28)25-10-8-7-9-11-25)16-27-29(35)31-30(38-27)33-17-21(3)37-22(4)18-33/h7-13,15-16,19,21-22H,5-6,14,17-18H2,1-4H3/b27-16-
InChIKey
GJPIEPOQHXDRAX-YUMHPJSZSA-N
Synonyms

(5Z)5((3(4butoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylidene)2(26dimethylmorpholin4yl)13thiazol4(5H)one
(5Z)5((3(4BUTOXY3METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2(26DIMETHYLMORPHOLIN4YL)13THIAZOL4ONE
(E)5((3(4butoxy3methylphenyl)1phenyl1Hpyrazol4yl)methylene)2(26dimethylmorpholino)thiazol4(5H)one
CCCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N4CC(OC(C4)C)C)C5=CC=CC=C5)C
CCCCOc1ccc(cc1C)c1nn(cc1C=C1SC(=NC1=O)N1CC(C)OC(C1)C)c1ccccc1
InChI=1SC30H34N4O3Sc156143626131223(1520(26)2)2824(1934(3228)25108791125)162729(35)3130(3827)331721(3)3722(4)1833h7131516192122H56141718H214H3b2716
MFCD03225791
ZINC000026687350
ZINC000026687356

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Available files

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