Vitas-M small molecule compound
ethyl (2Z)-5-(4-chlorophenyl)-7-methyl-2-[4-(naphthalen-1-ylmethoxy)benzylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK325755
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)/c(=C/c1ccc(cc1)OCc1cccc3c1cccc3)/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 C34H27ClN2O4S MW 595.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H27ClN2O4S/c1-3-40-33(39)30-21(2)36-34-37(31(30)24-13-15-26(35)16-14-24)32(38)29(42-34)19-22-11-17-27(18-12-22)41-20-25-9-6-8-23-7-4-5-10-28(23)25/h4-19,31H,3,20H2,1-2H3/b29-19-InChIKey
NCNZVBYOUIZWCG-CEUNXORHSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)c(=Cc1ccc(cc1)OCc1cccc3c1cccc3)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)Cl)C(=O)C(=CC4=CC=C(C=C4)OCC5=CC=CC6=CC=CC=C65)S2)C
ETHYL(2Z)5(4CHLOROPHENYL)7METHYL2((4(NAPHTHALEN1YLMETHOXY)PHENYL)METHYLIDENE)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)5(4CHLOROPHENYL)7METHYL2(4(NAPHTHALEN1YLMETHOXY)BENZYLIDENE)3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC34H27ClN2O4Sc134033(39)3021(2)363437(31(30)24131526(35)161424)32(38)29(4234)1922111727(181222)412025968237451028(23)25h41931H320H212H3b2919
MFCD01592437
ZINC000002062302
ZINC000002062304
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.