Vitas-M small molecule compound

ethyl (2Z)-5-(2-ethoxy-3-methoxyphenyl)-2-{4-[(3-fluorobenzyl)oxy]-3-methoxybenzylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK106867
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1OCC)OC)c(=O)/c(=C/c1ccc(c(c1)OC)OCc1cccc(c1)F)/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 C34H33FN2O7S MW 632.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H33FN2O7S/c1-6-42-31-24(12-9-13-26(31)40-4)30-29(33(39)43-7-2)20(3)36-34-37(30)32(38)28(45-34)18-21-14-15-25(27(17-21)41-5)44-19-22-10-8-11-23(35)16-22/h8-18,30H,6-7,19H2,1-5H3/b28-18-
InChIKey
NQJPPBHEJDXWNL-VEILYXNESA-N
Synonyms

CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1OCC)OC)c(=O)c(=Cc1ccc(c(c1)OC)OCc1cccc(c1)F)s2
CCOC1=C(C=CC=C1OC)C2C(=C(N=C3N2C(=O)C(=CC4=CC(=C(C=C4)OCC5=CC(=CC=C5)F)OC)S3)C)C(=O)OCC
ETHYL(2Z)5(2ETHOXY3METHOXYPHENYL)2((4((3FLUOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)5(2ETHOXY3METHOXYPHENYL)2(4((3FLUOROBENZYL)OXY)3METHOXYBENZYLIDENE)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC34H33FN2O7Sc16423124(1291326(31)404)3029(33(39)4372)20(3)363437(30)32(38)28(4534)1821141525(27(1721)415)4419221081123(35)1622h81830H6719H215H3b2818
MFCD03167901
ZINC000097959550
ZINC000097959551

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Available files

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