Vitas-M small molecule compound
methyl 4-[8-cyano-3-(4-ethoxyphenyl)-3-hydroxy-5-oxo-2,3,6,7-tetrahydro-5H-[1,3]thiazolo[3,2-a]pyridin-7-yl]benzoate
Catalog ID
STK827143
SMILES CCOc1ccc(cc1)C1(O)CSC2=C(C(CC(=O)N12)c1ccc(cc1)C(=O)OC)C#N
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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 C24H22N2O5S MW 450.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O5S/c1-3-31-18-10-8-17(9-11-18)24(29)14-32-22-20(13-25)19(12-21(27)26(22)24)15-4-6-16(7-5-15)23(28)30-2/h4-11,19,29H,3,12,14H2,1-2H3InChIKey
RTNZBEYJDUTBKU-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)C2(CSC3=C(C(CC(=O)N32)C4=CC=C(C=C4)C(=O)OC)C#N)O
InChI=1SC24H22N2O5Sc13311810817(91118)24(29)14322220(1325)19(1221(27)26(22)24)154616(7515)23(28)302h4111929H31214H212H3
methyl4(8cyano3(4ethoxyphenyl)3hydroxy5oxo2367tetrahydro5H(13)thiazolo(32a)pyridin7yl)benzoate
methyl4(8cyano3(4ethoxyphenyl)3hydroxy5oxo67dihydro2H(13)thiazolo(32a)pyridin7yl)benzoate
MFCD10087254
ZINC000012275249
ZINC000012275254
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