Vitas-M small molecule compound
ethyl (2Z)-2-(2-methoxybenzylidene)-3-oxo-7-phenyl-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK326624
SMILES CCOC(=O)C1=C(N=c2n(C1c1cccs1)c(=O)/c(=C/c1ccccc1OC)/s2)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 C27H22N2O4S2 MW 502.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H22N2O4S2/c1-3-33-26(31)22-23(17-10-5-4-6-11-17)28-27-29(24(22)20-14-9-15-34-20)25(30)21(35-27)16-18-12-7-8-13-19(18)32-2/h4-16,24H,3H2,1-2H3/b21-16-InChIKey
CCWROZXMXRSXEK-PGMHBOJBSA-NSynonyms
CCOC(=O)C1=C(N=c2n(C1c1cccs1)c(=O)c(=Cc1ccccc1OC)s2)c1ccccc1
CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=O)C(=CC4=CC=CC=C4OC)S2)C5=CC=CC=C5
ETHYL(2Z)2((2METHOXYPHENYL)METHYLIDENE)3OXO7PHENYL5THIOPHEN2YL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)2(2METHOXYBENZYLIDENE)3OXO7PHENYL5(THIOPHEN2YL)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC27H22N2O4S2c133326(31)2223(17105461117)282729(24(22)20149153420)25(30)21(3527)161812781319(18)322h41624H3H212H3b2116
MFCD02195773
ZINC000003766364
ZINC000003766366
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