Vitas-M small molecule compound
ethyl (2E)-5-(2-methoxyphenyl)-7-methyl-2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK897074
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC)c(=O)/c(=C\c1sccc1C)/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 C23H22N2O4S2 MW 454.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O4S2/c1-5-29-22(27)19-14(3)24-23-25(20(19)15-8-6-7-9-16(15)28-4)21(26)18(31-23)12-17-13(2)10-11-30-17/h6-12,20H,5H2,1-4H3/b18-12+InChIKey
HGQIRLMBKUNZRD-LDADJPATSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1OC)c(=O)c(=Cc1sccc1C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3OC)C(=O)C(=CC4=C(C=CS4)C)S2)C
ethyl(2E)5(2methoxyphenyl)7methyl2((3methylthiophen2yl)methylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)5(2methoxyphenyl)7methyl2((3methylthiophen2yl)methylidene)3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL5(2METHOXYPHENYL)7METHYL2((3METHYL(2THIENYL))METHYLENE)3OXO45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC23H22N2O4S2c152922(27)1914(3)242325(20(19)15867916(15)284)21(26)18(3123)121713(2)10113017h61220H5H214H3b1812+
MFCD03650889
ZINC000008779066
ZINC000008779067
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