Vitas-M small molecule compound
methyl (2Z)-2-({phenyl[(pyridin-3-ylcarbonyl)amino]acetyl}imino)-5-(propan-2-yl)-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL320087
SMILES COC(=O)c1[nH]/c(=N/C(=O)C(c2ccccc2)NC(=O)c2cccnc2)/sc1C(C)C
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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 C22H22N4O4S MW 438.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O4S/c1-13(2)18-17(21(29)30-3)25-22(31-18)26-20(28)16(14-8-5-4-6-9-14)24-19(27)15-10-7-11-23-12-15/h4-13,16H,1-3H3,(H,24,27)(H,25,26,28)InChIKey
ZKFCZUUGHPELRO-UHFFFAOYSA-NSynonyms
CC(C)C1=C(N=C(S1)NC(=O)C(C2=CC=CC=C2)NC(=O)C3=CN=CC=C3)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)C(c2ccccc2)NC(=O)c2cccnc2)sc1C(C)C
InChI=1SC22H22N4O4Sc113(2)1817(21(29)303)2522(3118)2620(28)16(148546914)2419(27)1510711231215h41316H13H3(H2427)(H252628)
methyl(2Z)2((phenyl((pyridin3ylcarbonyl)amino)acetyl)imino)5(propan2yl)23dihydro13thiazole4carboxylate
methyl2((2phenyl2(pyridine3carbonylamino)acetyl)amino)5propan2yl13thiazole4carboxylate
MFCD28029292
ZINC000095480549
ZINC000095480550
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