Vitas-M small molecule compound
methyl (2E)-2-(2-ethoxybenzylidene)-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK797807
SMILES CCOc1ccccc1/C=c\1/sc2=NC(=C(C(n2c1=O)c1cccs1)C(=O)OC)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 C22H20N2O4S2 MW 440.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O4S2/c1-4-28-15-9-6-5-8-14(15)12-17-20(25)24-19(16-10-7-11-29-16)18(21(26)27-3)13(2)23-22(24)30-17/h5-12,19H,4H2,1-3H3/b17-12+InChIKey
JVLBSOGCQNTBQF-SFQUDFHCSA-NSynonyms
CCOC1=CC=CC=C1C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OC)C4=CC=CS4
CCOc1ccccc1C=c1sc2=NC(=C(C(n2c1=O)c1cccs1)C(=O)OC)C
InChI=1SC22H20N2O4S2c142815965814(15)121720(25)2419(16107112916)18(21(26)273)13(2)2322(24)3017h51219H4H213H3b1712+
METHYL(2E)2((2ETHOXYPHENYL)METHYLIDENE)7METHYL3OXO5THIOPHEN2YL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
methyl(2E)2(2ethoxybenzylidene)7methyl3oxo5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD03417174
ZINC000016699921
ZINC000016699923
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