Vitas-M small molecule compound
ethyl [(2E)-2-({[1-phenyl-3-(propan-2-yl)-1H-pyrazol-5-yl]carbonyl}imino)-2,3-dihydro-1,3-thiazol-4-yl]acetate
Catalog ID
STL152651
SMILES CCOC(=O)Cc1cs/c(=N/C(=O)c2cc(nn2c2ccccc2)C(C)C)/[nH]1
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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 C20H22N4O3S MW 398.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O3S/c1-4-27-18(25)10-14-12-28-20(21-14)22-19(26)17-11-16(13(2)3)23-24(17)15-8-6-5-7-9-15/h5-9,11-13H,4,10H2,1-3H3,(H,21,22,26)InChIKey
OLKRYFLRSFTSLM-UHFFFAOYSA-NSynonyms
1282112-21-31282112213
CCOC(=O)CC1=CSC(=N1)NC(=O)C2=CC(=NN2C3=CC=CC=C3)C(C)C
CCOC(=O)Cc1csc(=NC(=O)c2cc(nn2c2ccccc2)C(C)C)(nH)1
ethyl((2E)2(((1phenyl3(propan2yl)1Hpyrazol5yl)carbonyl)imino)23dihydro13thiazol4yl)acetate
ethyl2(2((2phenyl5propan2ylpyrazole3carbonyl)amino)13thiazol4yl)acetate
InChI=1SC20H22N4O3Sc142718(25)1014122820(2114)2219(26)171116(13(2)3)2324(17)158657915h591113H410H213H3(H212226)
MFCD20756427
ZINC000061719700
ZINC61719700
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