Vitas-M small molecule compound
1-[(5Z)-5-{[3-(2-methyl-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperidine-4-carboxamide
Catalog ID
STK810380
SMILES CCCOc1ccc(c(c1)C)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 C29H31N5O3S MW 529.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N5O3S/c1-3-15-37-23-9-10-24(19(2)16-23)26-21(18-34(32-26)22-7-5-4-6-8-22)17-25-28(36)31-29(38-25)33-13-11-20(12-14-33)27(30)35/h4-10,16-18,20H,3,11-15H2,1-2H3,(H2,30,35)/b25-17-InChIKey
MCHOTECJYCKVNS-UQQQWYQISA-NSynonyms
1((5Z)5((3(2methyl4propoxyphenyl)1phenyl1Hpyrazol4yl)methylidene)4oxo45dihydro13thiazol2yl)piperidine4carboxamide
1((5Z)5((3(2METHYL4PROPOXYPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)4OXO13THIAZOL2YL)PIPERIDINE4CARBOXAMIDE
CCCOC1=CC(=C(C=C1)C2=NN(C=C2C=C3C(=O)N=C(S3)N4CCC(CC4)C(=O)N)C5=CC=CC=C5)C
CCCOc1ccc(c(c1)C)c1nn(cc1C=C1SC(=NC1=O)N1CCC(CC1)C(=O)N)c1ccccc1
InChI=1SC29H31N5O3Sc1315372391024(19(2)1623)2621(1834(3226)227546822)172528(36)3129(3825)33131120(121433)27(30)35h410161820H31115H212H3(H23035)b2517
MFCD03696006
ZINC000016701072
ZINC16701072
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