Vitas-M small molecule compound
prop-2-en-1-yl (2Z)-2-(2,5-dimethoxybenzylidene)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK798085
SMILES C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C/c1cc(OC)ccc1OC)/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 C27H26N2O6S MW 506.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O6S/c1-6-13-35-26(31)23-16(2)28-27-29(24(23)17-7-9-19(32-3)10-8-17)25(30)22(36-27)15-18-14-20(33-4)11-12-21(18)34-5/h6-12,14-15,24H,1,13H2,2-5H3/b22-15-InChIKey
MRUCFGVQHOBARO-JCMHNJIXSA-NSynonyms
C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1cc(OC)ccc1OC)s2
CC1=C(C(N2C(=O)C(=CC3=C(C=CC(=C3)OC)OC)SC2=N1)C4=CC=C(C=C4)OC)C(=O)OCC=C
InChI=1SC27H26N2O6Sc16133526(31)2316(2)282729(24(23)177919(323)10817)25(30)22(3627)15181420(334)111221(18)345h612141524H113H225H3b2215
MFCD03461863
prop2en1yl(2Z)2(25dimethoxybenzylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROP2ENYL(2Z)2((25DIMETHOXYPHENYL)METHYLIDENE)5(4METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000002708993
ZINC000002708996
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