Vitas-M small molecule compound
prop-2-en-1-yl (2Z)-2-[4-(benzyloxy)benzylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK797878
SMILES C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C/c1ccc(cc1)OCc1ccccc1)/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 C32H28N2O5S MW 552.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28N2O5S/c1-4-18-38-31(36)28-21(2)33-32-34(29(28)24-12-16-25(37-3)17-13-24)30(35)27(40-32)19-22-10-14-26(15-11-22)39-20-23-8-6-5-7-9-23/h4-17,19,29H,1,18,20H2,2-3H3/b27-19-InChIKey
AZADDVCMTPGTJF-DIBXZPPDSA-NSynonyms
C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1ccc(cc1)OCc1ccccc1)s2
CC1=C(C(N2C(=O)C(=CC3=CC=C(C=C3)OCC4=CC=CC=C4)SC2=N1)C5=CC=C(C=C5)OC)C(=O)OCC=C
InChI=1SC32H28N2O5Sc14183831(36)2821(2)333234(29(28)24121625(373)171324)30(35)27(4032)1922101426(151122)3920238657923h4171929H11820H223H3b2719
MFCD03461789
prop2en1yl(2Z)2(4(benzyloxy)benzylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROP2ENYL(2Z)5(4METHOXYPHENYL)7METHYL3OXO2((4PHENYLMETHOXYPHENYL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000002704377
ZINC000002704381
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