Vitas-M small molecule compound
ethyl (2E)-2-{4-[(2-chlorobenzyl)oxy]-3-ethoxybenzylidene}-5-(4-methoxynaphthalen-1-yl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK675834
SMILES CCOc1cc(ccc1OCc1ccccc1Cl)/C=c\1/sc2=NC(=C(C(n2c1=O)c1ccc(c2c1cccc2)OC)C(=O)OCC)C
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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 C37H33ClN2O6S MW 669.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H33ClN2O6S/c1-5-44-31-19-23(15-17-30(31)46-21-24-11-7-10-14-28(24)38)20-32-35(41)40-34(33(36(42)45-6-2)22(3)39-37(40)47-32)27-16-18-29(43-4)26-13-9-8-12-25(26)27/h7-20,34H,5-6,21H2,1-4H3/b32-20+InChIKey
NPVTZQYQTINPTE-UZWMFBFFSA-NSynonyms
CCOC1=C(C=CC(=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC)C4=CC=C(C5=CC=CC=C45)OC)OCC6=CC=CC=C6Cl
CCOc1cc(ccc1OCc1ccccc1Cl)C=c1sc2=NC(=C(C(n2c1=O)c1ccc(c2c1cccc2)OC)C(=O)OCC)C
ETHYL(2E)2((4((2CHLOROPHENYL)METHOXY)3ETHOXYPHENYL)METHYLIDENE)5(4METHOXYNAPHTHALEN1YL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2E)2(4((2chlorobenzyl)oxy)3ethoxybenzylidene)5(4methoxynaphthalen1yl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL2(4((2CHLOROBENZYL)OXY)3ETHOXYBENZYLIDENE)5(4METHOXY1NAPHTHYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC37H33ClN2O6Sc1544311923(151730(31)462124117101428(24)38)203235(41)4034(33(36(42)4562)22(3)3937(40)4732)27161829(434)2613981225(26)27h72034H5621H214H3b3220+
MFCD01799874
ZINC000008425516
ZINC000008425518
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