Vitas-M small molecule compound
ethyl (2Z)-2-[(1,2-dimethyl-1H-indol-3-yl)methylidene]-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK004096
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)SC)c(=O)/c(=C/c1c(C)n(c3c1cccc3)C)/s2
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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 C28H27N3O3S2 MW 517.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27N3O3S2/c1-6-34-27(33)24-16(2)29-28-31(25(24)18-11-13-19(35-5)14-12-18)26(32)23(36-28)15-21-17(3)30(4)22-10-8-7-9-20(21)22/h7-15,25H,6H2,1-5H3/b23-15-InChIKey
XAJQZKQNKFQVSF-HAHDFKILSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)SC)c(=O)c(=Cc1c(C)n(c3c1cccc3)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)SC)C(=O)C(=CC4=C(N(C5=CC=CC=C54)C)C)S2)C
ETHYL(2Z)2((12DIMETHYL1HINDOL3YL)METHYLIDENE)7METHYL5(4(METHYLSULFANYL)PHENYL)3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)2((12DIMETHYLINDOL3YL)METHYLIDENE)7METHYL5(4METHYLSULFANYLPHENYL)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H27N3O3S2c163427(33)2416(2)292831(25(24)18111319(355)141218)26(32)23(3628)152117(3)30(4)221087920(21)22h71525H6H215H3b2315
MFCD03032437
STK004096
ZINC000008916650
ZINC000008916651
Check stock
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Check stock on Vitas-MAvailable files
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