Vitas-M small molecule compound
ethyl (2Z)-5-(5-bromo-2,4-dimethoxyphenyl)-2-[(2,7-dimethoxynaphthalen-1-yl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK675825
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cc(Br)c(cc1OC)OC)c(=O)/c(=C/c1c(OC)ccc3c1cc(OC)cc3)/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 C31H29BrN2O7S MW 653.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29BrN2O7S/c1-7-41-30(36)27-16(2)33-31-34(28(27)21-13-22(32)25(40-6)15-24(21)39-5)29(35)26(42-31)14-20-19-12-18(37-3)10-8-17(19)9-11-23(20)38-4/h8-15,28H,7H2,1-6H3/b26-14-InChIKey
KLJAXGYQHYCZBL-WGARJPEWSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1cc(Br)c(cc1OC)OC)c(=O)c(=Cc1c(OC)ccc3c1cc(OC)cc3)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3OC)OC)Br)C(=O)C(=CC4=C(C=CC5=C4C=C(C=C5)OC)OC)S2)C
ethyl(2Z)5(5bromo24dimethoxyphenyl)2((27dimethoxynaphthalen1yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(5BROMO24DIMETHOXYPHENYL)2((27DIMETHOXYNAPHTHALEN1YL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL5(5BROMO24DIMETHOXYPHENYL)2((27DIMETHOXY1NAPHTHYL)METHYLENE)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC31H29BrN2O7Sc174130(36)2716(2)333134(28(27)211322(32)25(406)1524(21)395)29(35)26(4231)1420191218(373)10817(19)91123(20)384h81528H7H216H3b2614
MFCD01801696
ZINC000008425461
ZINC000008425463
Check stock
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Check stock on Vitas-MAvailable files
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