Vitas-M small molecule compound
ethyl (2Z)-2-{[1-(biphenyl-4-yl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-7-methyl-5-(4-methylphenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL438518
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)/c(=C/c1cc(n(c1C)c1ccc(cc1)c1ccccc1)C)/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 C36H33N3O3S MW 587.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H33N3O3S/c1-6-42-35(41)32-24(4)37-36-39(33(32)28-14-12-22(2)13-15-28)34(40)31(43-36)21-29-20-23(3)38(25(29)5)30-18-16-27(17-19-30)26-10-8-7-9-11-26/h7-21,33H,6H2,1-5H3/b31-21-InChIKey
WWYQIDRTRCVVHQ-YQYKVWLJSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)c(=Cc1cc(n(c1C)c1ccc(cc1)c1ccccc1)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C)C(=O)C(=CC4=C(N(C(=C4)C)C5=CC=C(C=C5)C6=CC=CC=C6)C)S2)C
ethyl(2Z)2((1(biphenyl4yl)25dimethyl1Hpyrrol3yl)methylidene)7methyl5(4methylphenyl)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((25DIMETHYL1(4PHENYLPHENYL)PYRROL3YL)METHYLIDENE)7METHYL5(4METHYLPHENYL)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC36H33N3O3Sc164235(41)3224(4)373639(33(32)28141222(2)131528)34(40)31(4336)21292023(3)38(25(29)5)30181627(171930)26108791126h72133H6H215H3b3121
MFCD01140802
ZINC000002914768
ZINC000002914773
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.