Vitas-M small molecule compound
ethyl (2Z)-2-[4-(dimethylamino)benzylidene]-5-(2-ethoxy-3-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK108938
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1OCC)OC)c(=O)/c(=C/c1ccc(cc1)N(C)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 C28H31N3O5S MW 521.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O5S/c1-7-35-25-20(10-9-11-21(25)34-6)24-23(27(33)36-8-2)17(3)29-28-31(24)26(32)22(37-28)16-18-12-14-19(15-13-18)30(4)5/h9-16,24H,7-8H2,1-6H3/b22-16-InChIKey
XQQAHQYIARMFOO-JWGURIENSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1OCC)OC)c(=O)c(=Cc1ccc(cc1)N(C)C)s2
CCOC1=C(C=CC=C1OC)C2C(=C(N=C3N2C(=O)C(=CC4=CC=C(C=C4)N(C)C)S3)C)C(=O)OCC
ethyl(2Z)2((4(dimethylamino)phenyl)methylidene)5(2ethoxy3methoxyphenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((4DIMETHYLAMINOPHENYL)METHYLIDENE)5(2ETHOXY3METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)2(4(DIMETHYLAMINO)BENZYLIDENE)5(2ETHOXY3METHOXYPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H31N3O5Sc17352520(1091121(25)346)2423(27(33)3682)17(3)292831(24)26(32)22(3728)1618121419(151318)30(4)5h91624H78H216H3b2216
MFCD03167892
ZINC000002177030
ZINC000002177032
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Check stock on Vitas-MAvailable files
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