Vitas-M small molecule compound
methyl (2E)-2-{4-methoxy-3-[(2-methylphenoxy)methyl]benzylidene}-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL174830
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C\c1ccc(c(c1)COc1ccccc1C)OC)/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 C32H30N2O6S MW 570.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N2O6S/c1-19-8-6-7-9-25(19)40-18-23-16-21(10-15-26(23)38-4)17-27-30(35)34-29(22-11-13-24(37-3)14-12-22)28(31(36)39-5)20(2)33-32(34)41-27/h6-17,29H,18H2,1-5H3/b27-17+InChIKey
CVOQRSODZAZSPT-WPWMEQJKSA-NSynonyms
445025-45-6445025456
CC1=CC=CC=C1OCC2=C(C=CC(=C2)C=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OC)C5=CC=C(C=C5)OC)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1ccc(c(c1)COc1ccccc1C)OC)s2
InChI=1SC32H30N2O6Sc119867925(19)4018231621(101526(23)384)172730(35)3429(22111324(373)141222)28(31(36)395)20(2)3332(34)4127h61729H18H215H3b2717+
METHYL(2E)2((4METHOXY3((2METHYLPHENOXY)METHYL)PHENYL)METHYLIDENE)5(4METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
methyl(2E)2(4methoxy3((2methylphenoxy)methyl)benzylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL2(4METHOXY3((2METHYLPHENOXY)METHYL)BENZYLIDENE)5(4METHOXYPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD03073926
ZINC000002777379
ZINC000002777381
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