Vitas-M small molecule compound
propan-2-yl (2Z)-5-(4-chlorophenyl)-2-[(2-methoxynaphthalen-1-yl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL506972
SMILES COc1ccc2c(c1/C=c/1\sc3=NC(=C(C(n3c1=O)c1ccc(cc1)Cl)C(=O)OC(C)C)C)cccc2
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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 C29H25ClN2O4S MW 533.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25ClN2O4S/c1-16(2)36-28(34)25-17(3)31-29-32(26(25)19-9-12-20(30)13-10-19)27(33)24(37-29)15-22-21-8-6-5-7-18(21)11-14-23(22)35-4/h5-16,26H,1-4H3/b24-15-InChIKey
FHMJECJCGXOFBR-IWIPYMOSSA-NSynonyms
5872250
InChI=1SC29H25ClN2O4Sc116(2)3628(34)2517(3)312932(26(25)1991220(30)131019)27(33)24(3729)152221865718(21)111423(22)354h51626H14H3b2415
MFCD31614610
propan2yl(2~(Z))5(4chlorophenyl)2((2methoxynaphthalen1yl)methylidene)7methyl3oxo5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
propan2yl(2Z)5(4chlorophenyl)2((2methoxynaphthalen1yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ZINC000103687477
ZINC000103687482
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