Vitas-M small molecule compound
ethyl (2Z)-5-(4-ethoxyphenyl)-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
STL495652
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OCC)c(=O)/c(=C/c1c(OC)ccc3c1cccc3)/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 C30H28N2O5S MW 528.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28N2O5S/c1-5-36-21-14-11-20(12-15-21)27-26(29(34)37-6-2)18(3)31-30-32(27)28(33)25(38-30)17-23-22-10-8-7-9-19(22)13-16-24(23)35-4/h7-17,27H,5-6H2,1-4H3/b25-17-InChIKey
DQYCWGDAAUSUMY-UQQQWYQISA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OCC)c(=O)c(=Cc1c(OC)ccc3c1cccc3)s2
CCOC1=CC=C(C=C1)C2C(=C(N=C3N2C(=O)C(=CC4=C(C=CC5=CC=CC=C54)OC)S3)C)C(=O)OCC
ethyl(2Z)5(4ethoxyphenyl)2((2methoxynaphthalen1yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4ETHOXYPHENYL)2((2METHOXYNAPHTHALEN1YL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL5(4ETHOXYPHENYL)2((2METHOXY1NAPHTHYL)METHYLENE)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC30H28N2O5Sc153621141120(121521)2726(29(34)3762)18(3)313032(27)28(33)25(3830)1723221087919(22)131624(23)354h71727H56H214H3b2517
MFCD02070352
ZINC000002120543
ZINC000002120547
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.